SCHEMBL7212898

SCHEMBL7212898

O=C(COP(=O)(OCc1ccccc1)OCc1ccccc1)Oc1ccc(Cl)cc1Cn1nc(-c2ccc(C(F)(F)F)cc2)oc1=O

nearest known ligand 0.56

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 17/20 0.40

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
SCHEMBL7207844 0.89 PTGER1 (0.41) PTGER1
SCHEMBL7208501 0.88 CETP (0.37) PTGER1
SCHEMBL7212901 0.83 PTGER1 (0.39) PTGER1
SCHEMBL7209116 0.82 GAA (0.38) PTGER1
SCHEMBL7506976 0.82 PTGER1 (0.37) PTGER1
SCHEMBL8058096 0.81 CETP (0.38) PTGER1
SCHEMBL7208535 0.79 CETP (0.35) PTGER1
SCHEMBL7207878 0.78 CETP (0.37) PTGER1
SCHEMBL7209076 0.78 GAA (0.37) PTGER1
SCHEMBL7212720 0.78 CETP (0.38) PTGER1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1056754-B1 PHOSPHATE DERIVATIVES OF DIARYL 1,3,4-OXADIAZOLONE BRISTOL MYERS SQUIBB CO (US) 2003-10-22 EP disclosed
EP-1056754-A4 PHOSPHATE DERIVATIVES OF DIARYL 1,3,4-OXADIAZOLONE BRISTOL MYERS SQUIBB CO (US) 2002-03-06 EP disclosed
EP-1056754-A1 PHOSPHATE DERIVATIVES OF DIARYL 1,3,4-OXADIAZOLONE Bristol-Myers Squibb Company (US) 2000-12-06 EP disclosed
WO-1999038873-A1 PHOSPHATE DERIVATIVES OF DIARYL 1,3,4-OXADIAZOLONE BRISTOL-MYERS SQUIBB COMPANY (US) 1999-08-05 WO disclosed