SCHEMBL2742865

SCHEMBL2742865

CC(C)(Oc1ccc(C(=O)c2ccc(Cl)cc2)cc1)C(O)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 7/20 0.65
▸ PPARG P37231 3/20 0.65
▸ FABP2 P12104 1/20 0.65
▸ SLC22A12 Q96S37 1/20 0.65
▸ CYP1A2 P05177 3/20 0.61
▸ CYP3A4 P08684 3/20 0.61
▸ MAPT P10636 3/20 0.61
▸ HPGD P15428 2/20 0.61
▸ MEN1 O00255 2/20 0.61
▸ CYP2C19 P33261 2/20 0.61
▸ KMT2A Q03164 2/20 0.61
▸ MAPK1 P28482 2/20 0.61
▸ ABCB11 O95342 2/20 0.61
▸ TSHR P16473 2/20 0.61
▸ HTR2A P28223 2/20 0.61
▸ PMP22 Q01453 2/20 0.61
▸ LMNA P02545 2/20 0.61
▸ SMN1; SMN2 Q16637 2/20 0.61
▸ USP2 O75604 1/20 0.61
▸ ADORA3 P0DMS8 1/20 0.61

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
SCHEMBL10971208 0.89 PPARA (0.63) PPARAPPARGFABP2SLC22A12CYP1A2
SCHEMBL17299693 0.87 PPARA (0.65) PPARAPPARGFABP2SLC22A12CYP1A2
SCHEMBL19597518 0.84 PPARA (0.61) PPARAPPARGFABP2SLC22A12CYP1A2
SCHEMBL10190646 0.83 PPARA (0.73) PPARAPPARGFABP2SLC22A12CYP1A2
SCHEMBL30657556 0.80 PPARA (0.69) PPARAPPARGFABP2SLC22A12CYP1A2
SCHEMBL822492 0.79 PPARA (0.77) PPARAPPARGFABP2SLC22A12CYP1A2
Fenofibric Acid SCHEMBL16377 0.79 PPARA (1.00) PPARAPPARGFABP2SLC22A12CYP1A2
SCHEMBL13984052 0.79 PPARA (0.77) PPARAPPARGFABP2SLC22A12CYP1A2
SCHEMBL22209179 0.78 PPARA (0.70) PPARAPPARGFABP2SLC22A12CYP1A2
SCHEMBL10972527 0.78 CNR1 (0.65) PPARAPPARGFABP2SLC22A12CYP1A2

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-8859494-B2 Spirocyclically substituted 1,3-propane dioxide derivatives, processes for preparation thereof and use thereof as a medicament SANOFI (FR) 2014-10-14 — — US disclosed
US-8859494-B2 Spirocyclically substituted 1,3-propane dioxide derivatives, processes for preparation thereof and use thereof as a medicament SANOFI (FR) 2014-10-14 — — US disclosed
US-8530413-B2 Heterocyclically substituted methoxyphenyl derivatives with an oxo group, processes for preparation thereof and use thereof as medicaments SANOFI (FR) 2013-09-10 — — US disclosed
US-8530413-B2 Heterocyclically substituted methoxyphenyl derivatives with an oxo group, processes for preparation thereof and use thereof as medicaments SANOFI (FR) 2013-09-10 — — US disclosed
US-20120004165-A1 HETEROCYCLICALLY SUBSTITUTED METHOXYPHENYL DERIVATIVES WITH AN OXO GROUP, PROCESSES FOR PREPARATION THEREOF AND USE THEREOF AS MEDICAMENTS SANOFI (FR) 2012-01-05 — — US disclosed
US-20120004165-A1 HETEROCYCLICALLY SUBSTITUTED METHOXYPHENYL DERIVATIVES WITH AN OXO GROUP, PROCESSES FOR PREPARATION THEREOF AND USE THEREOF AS MEDICAMENTS SANOFI (FR) 2012-01-05 — — US disclosed
US-20120004187-A1 SPIROCYCLICALLY SUBSTITUTED 1,3-PROPANE DIOXIDE DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND USE THEREOF AS A MEDICAMENT SANOFI (FR) 2012-01-05 — — US disclosed
US-20120004187-A1 SPIROCYCLICALLY SUBSTITUTED 1,3-PROPANE DIOXIDE DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND USE THEREOF AS A MEDICAMENT SANOFI (FR) 2012-01-05 — — US 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 (2 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-20120004165-A1 HETEROCYCLICALLY SUBSTITUTED METHOXYPHENYL DERIVATIVES WITH AN OXO GROUP, PROCESSES FOR PREPARATION THEREOF AND USE THEREOF AS MEDICAMENTS CYP4B1, CYP4F3, CYP11B1 PPARA 2037/4885PPARG 1621/4885FABP2 4531/4885
US-20120004187-A1 SPIROCYCLICALLY SUBSTITUTED 1,3-PROPANE DIOXIDE DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND USE THEREOF AS A MEDICAMENT REN, PKD1, AKR1C3 PPARA 142/4885PPARG 313/4885FABP2 4397/4885

“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.

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