SCHEMBL7482185

SCHEMBL7482185

Cc1cc(CCn2ccc3cc(C(=O)O)ccc32)c2c(n1)CC=CC2

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.39
PPARA Q07869 1/20 0.39
NR1H3 Q13133 1/20 0.39
PLA2G4A P47712 2/20 0.38
MCL1 Q07820 3/20 0.37
BCL2 P10415 2/20 0.36
RAPGEF4 Q8WZA2 1/20 0.36
RXRA P19793 1/20 0.36
PLG P00747 1/20 0.36
PLAU P00749 1/20 0.36
PPARG P37231 6/20 0.36
CDK4 P11802 1/20 0.36
CCND1 P24385 1/20 0.36

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
SCHEMBL5898009 0.91 PPARG (0.42) PLA2G4APLAUPPARG
SCHEMBL6595653 0.72 MMP3 (0.41) PPARG
SCHEMBL4934703 0.71 PLA2G4A (0.55) NR1H2PPARANR1H3PLA2G4AMCL1
SCHEMBL28586559 0.71 RORC (0.50) PPARAPLA2G4AMCL1BCL2PLG
SCHEMBL1664063 0.70 PLG (0.51) PLA2G4AMCL1BCL2RAPGEF4PLG
SCHEMBL1749895 0.69 PLA2G4A (0.59) NR1H2PPARANR1H3PLA2G4AMCL1
SCHEMBL5387474 0.69 TUBB4A (0.59) PLA2G4ARAPGEF4PLGPLAUPPARG
SCHEMBL6752488 0.68 HTR2C (0.55) PLA2G4ARAPGEF4PLGPLAU
SCHEMBL1809906 0.68 HCAR3 (0.53) PLA2G4AMCL1BCL2PLGPLAU
SCHEMBL846081 0.68 PLA2G4A (0.61) NR1H2PPARANR1H3PLA2G4AMCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1263755-A2 CYCLIC BETA-AMINO ACID DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEASES AND TNF-ALPHA Bristol-Myers Squibb Pharma Company (US) 2002-12-11 EP disclosed
WO-2001070673-A2 CYCLIC β-AMINO ACID DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEASES AND TNF-$g(a) BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-09-27 WO disclosed