SCHEMBL289911

SCHEMBL289911

CC(C(=O)O)c1cc(O)cc(OCc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
ALOX5 P09917 2/20 0.50
MAOB P27338 3/20 0.49
CYP1A2 P05177 2/20 0.49
CYP1A1 P04798 1/20 0.49
CYP19A1 P11511 1/20 0.49
PTGS1 P23219 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
RRM1 P23921 1/20 0.47
LMNA P02545 2/20 0.46
SLC6A2 P23975 1/20 0.46
CYP2C19 P33261 1/20 0.46
PTGS2 P35354 1/20 0.46
SLC6A3 Q01959 1/20 0.46
HIF1A Q16665 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46

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
SCHEMBL14032970 0.93 KMT2A (0.59) KMT2AMEN1ALOX5MAOBPTGS1
SCHEMBL2986567 0.84 ALOX5 (0.67) KMT2AMEN1ALOX5MAOBPTGS1
SCHEMBL1593103 0.83 PSEN1 (0.51) KMT2AMEN1ALOX5PTGS1SMN1; SMN2
SCHEMBL137505 0.83 PSEN1 (0.56) KMT2AMEN1ALOX5MAOBPTGS1
SCHEMBL2885897 0.82 ALOX5 (0.62) ALOX5MAOBCYP1A2PTGS1LMNA
SCHEMBL289919 0.81 KMT2A (0.47) KMT2AMEN1ALOX5PTGS1SMN1; SMN2
Hydrochloric Acid SCHEMBL6948842 0.81 ALOX5 (0.60) ALOX5MAOBLMNAL3MBTL1PPARG
SCHEMBL13802503 0.79 RXRA (0.57) ALOX5PTGS1LMNAPTGS2PPARG
SCHEMBL9586230 0.79 AKR1C3 (0.70) ALOX5MAOBCYP1A2PTGS1PTGS2
SCHEMBL3567867 0.78 PSEN1 (0.74) MAOBPTGS2PPARGPPARA

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9938221-B2 Substituted aromatic compounds and pharmaceutical uses thereof PROMETIC PHARMA SMT LIMITED (GB) 2018-04-10 US disclosed
US-9439882-B2 Compounds and compositions for the treatment of cancer PROMETIC BIOSCIENCES INC. (CA) 2016-09-13 US disclosed
US-20160023983-A1 SUBSTITUTED AROMATIC COMPOUNDS FOR THE TREATMENT OF PULMONARY FIBROSIS, LIVER FIBROSIS,SKIN FIBROSIS AND CARDIAC FIBROSIS PROMETIC BIOSCIENCES INC. (CA) 2016-01-28 US disclosed
US-20150313856-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CANCER PROMETIC PHARMA SMT LIMITED (GB) 2015-11-05 US disclosed
US-20150094372-A1 SUBSTITUTED AROMATIC COMPOUNDS AND PHARMACEUTICAL USES THEREOF Liminal Biosciences Limited (GB) 2015-04-02 US disclosed
US-8927765-B2 Substituted aromatic compounds and pharmaceutical uses thereof PROMETIC BIOSCIENCES INC. (CA) 2015-01-06 US disclosed
US-20120088784-A1 Substituted Aromatic Compounds and Pharmaceutical Uses thereof PROMETIC PHARMA SMT LIMITED (GB) 2012-04-12 US disclosed
EP-2427416-A1 SUBSTITUTED AROMATIC COMPOUNDS AND PHARMACEUTICAL USES THEREOF ProMetic BioSciences Inc. (CA) 2012-03-14 EP 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-20160023983-A1 SUBSTITUTED AROMATIC COMPOUNDS FOR THE TREATMENT OF PULMONARY FIBROSIS, LIVER FIBROSIS,SKIN FIBROSIS AND CARDIAC FIBROSIS PAH, HRH3, CFH KMT2A 1506/4885MEN1 1807/4885ALOX5 1074/4885
US-20150094372-A1 SUBSTITUTED AROMATIC COMPOUNDS AND PHARMACEUTICAL USES THEREOF TYR, PAH, REN KMT2A 2789/4885MEN1 4643/4885ALOX5 374/4885
US-20150313856-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CANCER DCK, TOP2B, TOP2A KMT2A 1361/4885MEN1 3382/4885ALOX5 3188/4885
US-20120088784-A1 Substituted Aromatic Compounds and Pharmaceutical Uses thereof TYR, PAH, REN KMT2A 2789/4885MEN1 4643/4885ALOX5 374/4885

“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.