SCHEMBL7764807

SCHEMBL7764807

Cc1ccc(-c2ccc(/C(CCC(=O)O)=N\O)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.56
PPARG P37231 4/20 0.48
PPARA Q07869 3/20 0.48
HDAC8 Q9BY41 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.46
CYP1A2 P05177 2/20 0.46
RAB9A P51151 2/20 0.46
LMNA P02545 2/20 0.46
FFAR1 O14842 1/20 0.46
HIF1A Q16665 1/20 0.46
ALDH1A1 P00352 3/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
ALOX12 P18054 1/20 0.45
HTT P42858 1/20 0.45
MEN1 O00255 1/20 0.42
KDM4E B2RXH2 1/20 0.42
DDAH1 O94760 1/20 0.42
CYP2C19 P33261 1/20 0.42
S1PR1 P21453 1/20 0.41

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
SCHEMBL7764810 1.00 KMT2A (0.56) KMT2APPARGPPARAHDAC8SMN1; SMN2
SCHEMBL28958977 0.95 KMT2A (0.61) KMT2APPARGPPARASMN1; SMN2RAB9A
SCHEMBL28958978 0.95 KMT2A (0.61) KMT2APPARGPPARASMN1; SMN2RAB9A
SCHEMBL10021382 0.83 HDAC8 (0.48) KMT2AHDAC8SMN1; SMN2CYP1A2RAB9A
SCHEMBL4426389 0.83 HDAC8 (0.48) KMT2AHDAC8SMN1; SMN2CYP1A2RAB9A
SCHEMBL4426383 0.83 HDAC8 (0.48) KMT2AHDAC8SMN1; SMN2CYP1A2RAB9A
SCHEMBL6412848 0.83 ALDH1A1 (0.54) PPARGPPARAHDAC8SMN1; SMN2CYP1A2
SCHEMBL4434852 0.83 ALDH1A1 (0.54) KMT2APPARGHDAC8SMN1; SMN2CYP1A2
SCHEMBL4434849 0.83 ALDH1A1 (0.54) KMT2APPARGHDAC8SMN1; SMN2CYP1A2
SCHEMBL6412854 0.83 ALDH1A1 (0.54) PPARGPPARAHDAC8SMN1; SMN2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6239288-B1 RHEUMATIC DISEASES WARNER-LAMBERT COMPANY 2001-05-29 US claimed
US-20010000513-A1 Biphenyl butyric acids and their derivatives as inhibitors of matrix metalloproteinases WARNER-LAMBERT COMPANY 2001-04-26 US claimed
EP-0927156-A1 BIPHENYL BUTYRIC ACIDS AND THEIR DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES WARNER-LAMBERT COMPANY (US) 1999-07-07 EP claimed
WO-1998009940-A1 BIPHENYL BUTYRIC ACIDS AND THEIR DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES WARNER-LAMBERT COMPANY (US) 1998-03-12 WO claimed
WO-2001090361-A2 MODULATION OF INFLAMMATION BY PROTEASE-TREATED MCP-3 CHEMOKINE THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2001-11-29 WO disclosed
US-6307089-B2 Biphenyl butyric acids and their derivatives as inhibitors of matrix metalloproteinases WARNER-LAMBERT COMPANY 2001-10-23 US disclosed
US-6239288-B1 RHEUMATIC DISEASES WARNER-LAMBERT COMPANY 2001-05-29 US disclosed
US-20010000513-A1 Biphenyl butyric acids and their derivatives as inhibitors of matrix metalloproteinases WARNER-LAMBERT COMPANY 2001-04-26 US disclosed
EP-0927156-A1 BIPHENYL BUTYRIC ACIDS AND THEIR DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES WARNER-LAMBERT COMPANY (US) 1999-07-07 EP disclosed
WO-1999021583-A1 METHOD OF INHIBITING METASTASES OF CANCER CELLS WARNER-LAMBERT COMPANY (US) 1999-05-06 WO disclosed
WO-1998009940-A1 BIPHENYL BUTYRIC ACIDS AND THEIR DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES WARNER-LAMBERT COMPANY (US) 1998-03-12 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 (1 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-20010000513-A1 Biphenyl butyric acids and their derivatives as inhibitors of matrix metalloproteinases MMP26, MMP1, MMP9 KMT2A 4671/4885PPARG 629/4885PPARA 1042/4885

“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.