SCHEMBL542933

SCHEMBL542933

CCOC(=O)C(Cc1ccc(OCCn2c(-c3ccc(F)cc3)c(-c3ccccc3)c(C(=O)Nc3ccccc3)c2C(C)C)cc1)OCC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLCO1B1 Q9Y6L6 4/20 0.54
HMGCR P04035 4/20 0.54
ABCB11 O95342 3/20 0.54
HDAC1 Q13547 2/20 0.54
HDAC2 Q92769 2/20 0.54
HDAC6 Q9UBN7 2/20 0.54
NR1I2 O75469 1/20 0.54
RHOC P08134 1/20 0.54
CYP3A4 P08684 1/20 0.54
THRB P10828 1/20 0.54
NR1H4 Q96RI1 1/20 0.54
ABCG2 Q9UNQ0 1/20 0.54
ABCC3 O15438 2/20 0.52
ABCC4 O15439 2/20 0.52
SLCO1B3 Q9NPD5 2/20 0.52
ABCB1 P08183 1/20 0.50
ABCC2 Q92887 1/20 0.50
PDE6D O43924 3/20 0.48
PPARG P37231 3/20 0.44
PPARA Q07869 3/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL543536 0.96 SLCO1B1 (0.53) SLCO1B1HMGCRABCB11HDAC1HDAC2
SCHEMBL543237 0.94 SLCO1B1 (0.55) SLCO1B1HMGCRABCB11HDAC1HDAC2
SCHEMBL542885 0.91 SLCO1B1 (0.54) SLCO1B1HMGCRABCB11HDAC1HDAC2
SCHEMBL16456490 0.87 SLCO1B1 (0.45) SLCO1B1HMGCRABCB11HDAC1HDAC2
SCHEMBL542880 0.85 PGR (0.46) PPARGPPARAPPARDPGRADORA3
SCHEMBL543539 0.82 PPARA (0.50) PPARGPPARAPPARDPGRADORA3
SCHEMBL6805916 0.82 PGR (0.43) PPARGPPARAPPARDPGRADORA3
SCHEMBL9365103 0.80 HMGCR (0.70) SLCO1B1HMGCRABCB11HDAC1HDAC2
SCHEMBL14308638 0.79 HMGCR (0.62) SLCO1B1HMGCRABCB11HDAC1HDAC2
SCHEMBL542949 0.79 PGR (0.60) PPARGPPARAPPARDPGRADORA3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1250323-B1 Compounds having hypolipidemic and hypocholesterolemic activities, process for their preparation and pharmaceutical compositions containing them CADILA HEALTHCARE LTD (IN) 2014-01-01 EP claimed
US-8110598-B2 (+-) Ethyl 3-{4-[2-(pyrrol-1-yl)ethoxy]phenyl}-2-ethoxypropanoate; hyperlipidaemia, hypercholesteremia, hyperglycemia, obesity, impaired glucose intolerance, leptin resistance, insulin resistance, reducing plasma glucose, triglycerides, total cholesterol, LDL, VLDL or free fatty acids in the plasma CADILA HEALTHCARE LIMITED (IN) 2012-02-07 US claimed
US-20080188402-A1 NOVEL HETEROCYCLIC COMPOUNDS, THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE IN MEDICINE CADILLA HEALTHCARE LIMITED (IN) 2008-08-07 US claimed
US-20040186099-A1 Novel heterocyclic compounds, their preparation, pharmaceutical compositions containing them and their use in medicine LOHRAY BRAJ BHUSHAN (IN) 2004-09-23 US claimed
US-20030236254-A1 Novel heterocyclic compounds having hypolipidemic, hypocholesteremic activities process for their preparation and pharmaceutical compositions containing them and their use in medicine CADILA HEALTHCARE LIMITED (IN) 2003-12-25 US claimed
US-20030199498-A1 Novel heterocyclic compounds, their preparation, pharmaceutical compositions containing them and their use in medicine CADILA HEALTHCARE LIMITED 2003-10-23 US claimed
EP-1250323-A2 COMPOUNDS HAVING HYPOLIPIDEMIC AND HYPOCHOLESTEROLEMIC ACTIVITIES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CADILA HEALTHCARE LTD. (IN) 2002-10-23 EP claimed
WO-2001053257-A2 COMPOUNDS HAVING HYPOLIPEDEMIC AND HYPOCHOLESTEREMIC ACTIVITIES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CADILA HEALTHCARE LTD. (IN) 2001-07-26 WO claimed
EP-1250323-B1 Compounds having hypolipidemic and hypocholesterolemic activities, process for their preparation and pharmaceutical compositions containing them CADILA HEALTHCARE LTD (IN) 2014-01-01 EP disclosed
US-8110598-B2 (+-) Ethyl 3-{4-[2-(pyrrol-1-yl)ethoxy]phenyl}-2-ethoxypropanoate; hyperlipidaemia, hypercholesteremia, hyperglycemia, obesity, impaired glucose intolerance, leptin resistance, insulin resistance, reducing plasma glucose, triglycerides, total cholesterol, LDL, VLDL or free fatty acids in the plasma CADILA HEALTHCARE LIMITED (IN) 2012-02-07 US disclosed
US-20080188402-A1 NOVEL HETEROCYCLIC COMPOUNDS, THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE IN MEDICINE CADILLA HEALTHCARE LIMITED (IN) 2008-08-07 US disclosed
US-7041837-B2 Heterocyclic compounds having hypolipidemic, hypocholesteremic activities process for their preparation and pharmaceutical compositions containing them and their use in medicine CADILLA HEALTHCARE LIMITED (IN) 2006-05-09 US disclosed
US-6987123-B2 Heterocyclic compounds, their preparation, pharmaceutical compositions containing them and their use in medicine CADILA HEALTHCARE LIMITED (IN) 2006-01-17 US disclosed
US-20030236254-A1 Novel heterocyclic compounds having hypolipidemic, hypocholesteremic activities process for their preparation and pharmaceutical compositions containing them and their use in medicine CADILA HEALTHCARE LIMITED (IN) 2003-12-25 US disclosed
US-20030199498-A1 Novel heterocyclic compounds, their preparation, pharmaceutical compositions containing them and their use in medicine CADILA HEALTHCARE LIMITED 2003-10-23 US disclosed
EP-1250323-A2 COMPOUNDS HAVING HYPOLIPIDEMIC AND HYPOCHOLESTEROLEMIC ACTIVITIES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CADILA HEALTHCARE LTD. (IN) 2002-10-23 EP disclosed
WO-2001053257-A2 COMPOUNDS HAVING HYPOLIPEDEMIC AND HYPOCHOLESTEREMIC ACTIVITIES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CADILA HEALTHCARE LTD. (IN) 2001-07-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030199498-A1 Novel heterocyclic compounds, their preparation, pharmaceutical compositions containing them and their use in medicine CYP11B2, CYP11B1, MAPT SLCO1B1 124/4885HMGCR 313/4885ABCB11 85/4885
US-20040186099-A1 Novel heterocyclic compounds, their preparation, pharmaceutical compositions containing them and their use in medicine CYP11B2, CYP11B1, MAPT SLCO1B1 124/4885HMGCR 313/4885ABCB11 85/4885
US-20030236254-A1 Novel heterocyclic compounds having hypolipidemic, hypocholesteremic activities process for their preparation and pharmaceutical compositions containing them and their use in medicine LIPA, LIPC, CYP46A1 SLCO1B1 2889/4885HMGCR 11/4885ABCB11 325/4885
US-20080188402-A1 NOVEL HETEROCYCLIC COMPOUNDS, THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE IN MEDICINE CYP11B2, MAPT, CYP11B1 SLCO1B1 127/4885HMGCR 294/4885ABCB11 151/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.