SCHEMBL7207878

SCHEMBL7207878

O=c1oc(-c2ccc(C(F)(F)F)cc2)nn1Cc1cc(Cl)ccc1OP(=O)(O)O

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CETP P11597 2/20 0.37
KMT2A Q03164 1/20 0.37
ABHD6 Q9BV23 1/20 0.36
NOTUM Q6P988 1/20 0.35
GAA P10253 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.34
PTGER1 P34995 4/20 0.34
PTGER4 P35408 1/20 0.33
MARS1 P56192 1/20 0.33

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
SCHEMBL7212720 0.90 CETP (0.38) CETPKMT2AABHD6NOTUMGAA
SCHEMBL7208501 0.87 CETP (0.37) CETPKMT2AABHD6GAAPTGDR2
SCHEMBL7141017 0.86 ABHD6 (0.43) KMT2AABHD6NOTUM
SCHEMBL7212915 0.86 KMT2A (0.39) CETPKMT2AABHD6NOTUMGAA
SCHEMBL7208535 0.86 CETP (0.35) CETPKMT2AABHD6GAAPTGDR2
SCHEMBL8058096 0.86 CETP (0.38) CETPKMT2AABHD6NOTUMGAA
SCHEMBL7213528 0.85 KMT2A (0.40) CETPKMT2AABHD6NOTUMGAA
SCHEMBL7207844 0.84 PTGER1 (0.41) PTGER1
SCHEMBL7209116 0.84 GAA (0.38) CETPKMT2AABHD6NOTUMGAA
SCHEMBL7208554 0.84 KMT2A (0.39) CETPKMT2AABHD6NOTUMPTGDR2

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 7 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 claimed
EP-1056754-A4 PHOSPHATE DERIVATIVES OF DIARYL 1,3,4-OXADIAZOLONE BRISTOL MYERS SQUIBB CO (US) 2002-03-06 EP claimed
EP-1056754-A1 PHOSPHATE DERIVATIVES OF DIARYL 1,3,4-OXADIAZOLONE Bristol-Myers Squibb Company (US) 2000-12-06 EP claimed
US-5939405-A Phosphate derivatives of diaryl 1,3,4-oxadiazolone BRISTOL-MYERS SQUIBB COMPANY (US) 1999-08-17 US claimed
WO-1999038873-A1 PHOSPHATE DERIVATIVES OF DIARYL 1,3,4-OXADIAZOLONE BRISTOL-MYERS SQUIBB COMPANY (US) 1999-08-05 WO claimed
EP-1056754-B1 PHOSPHATE DERIVATIVES OF DIARYL 1,3,4-OXADIAZOLONE BRISTOL MYERS SQUIBB CO (US) 2003-10-22 EP disclosed
US-5939405-A Phosphate derivatives of diaryl 1,3,4-oxadiazolone BRISTOL-MYERS SQUIBB COMPANY (US) 1999-08-17 US disclosed