SCHEMBL8845847

SCHEMBL8845847

CCCCCCCCCCOc1ccc(COc2cccc(CC(=O)O)c2-c2cccc(C(=O)O)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 3/20 0.53
PLA2G4B P0C869 7/20 0.50
RARB P10826 3/20 0.48
TP53 P04637 1/20 0.48
TSHR P16473 1/20 0.48
PTGER1 P34995 1/20 0.48

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
SCHEMBL8845974 0.92 PLA2G4B (0.46) PTPN11PLA2G4BPTGER1
SCHEMBL8845849 0.89 PTPN11 (0.52) PTPN11PTGER1
SCHEMBL8845537 0.81 PTPN11 (0.43) PTPN11PTGER1
SCHEMBL8846106 0.79 LTB4R (0.56) PTPN11PTGER1
SCHEMBL8845966 0.78 CFD (0.46) RARBTP53PTGER1
SCHEMBL8845944 0.77 PTPN11 (0.63) PTPN11PLA2G4BPTGER1
SCHEMBL8846113 0.76 PTPN11 (0.61) PTPN11PLA2G4BPTGER1
SCHEMBL28136287 0.74 TP53 (0.62) PLA2G4BRARBTP53TSHR
SCHEMBL8943435 0.74 TP53 (0.82) PLA2G4BRARBTP53TSHR
SCHEMBL9664886 0.74 TP53 (0.82) PLA2G4BRARBTP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0664282-B1 Biaryl phospholipase A2 inhibitors BRISTOL MYERS SQUIBB CO (US) 1997-10-22 EP claimed
EP-0664282-A1 Biaryl phospholipase A2 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 1995-07-26 EP claimed
US-5391817-A Antiinflammatory agents BRISTOL-MYERS SQUIBB (US) 1995-02-21 US claimed
EP-0664282-B1 Biaryl phospholipase A2 inhibitors BRISTOL MYERS SQUIBB CO (US) 1997-10-22 EP disclosed
EP-0664282-A1 Biaryl phospholipase A2 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 1995-07-26 EP disclosed
US-5391817-A Antiinflammatory agents BRISTOL-MYERS SQUIBB (US) 1995-02-21 US disclosed