SCHEMBL9201499

SCHEMBL9201499

NC(=O)c1cc(-c2ccc(N)cc2)n(-c2ccc(F)cc2)n1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.61
MEN1 O00255 2/20 0.61
ATM Q13315 1/20 0.61
RPA1 P27694 3/20 0.55
PPP1CA P62136 1/20 0.55
PTGS2 P35354 7/20 0.55
CHRNA7 P36544 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.50
PTGS1 P23219 4/20 0.47
KDM1A O60341 1/20 0.47
SMPD1 P17405 1/20 0.47
MALT1 Q9UDY8 1/20 0.46

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
SCHEMBL27422557 0.89 KMT2A (0.78) KMT2AMEN1ATMRPA1PPP1CA
SCHEMBL9209581 0.88 MEN1 (0.60) KMT2AMEN1ATMRPA1PPP1CA
SCHEMBL27694888 0.88 KMT2A (0.71) KMT2AMEN1ATMRPA1PPP1CA
SCHEMBL9209895 0.86 MEN1 (0.57) KMT2AMEN1ATMRPA1PPP1CA
SCHEMBL9209172 0.85 KDM1A (0.65) KMT2AMEN1ATMRPA1PPP1CA
SCHEMBL6344501 0.85 PTGS2 (0.76) PTGS2CHRNA7SMN1; SMN2PTGS1
SCHEMBL9209766 0.85 MEN1 (0.56) KMT2AMEN1ATMRPA1PPP1CA
SCHEMBL9207663 0.85 RPA1 (0.62) KMT2AMEN1ATMRPA1PPP1CA
SCHEMBL9199551 0.85 MEN1 (0.56) KMT2AMEN1ATMRPA1PPP1CA
SCHEMBL9199556 0.84 AOC3 (0.65) KMT2AMEN1ATMPTGS2CHRNA7

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
CN-1046506-C Pyrazole derivatives, processes for preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1999-11-17 CN disclosed
EP-0418845-B1 Pyrazole derivatives, processes for preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1995-08-09 EP disclosed
US-5134142-A PYRAZOLE DERIVATIVES, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-07-28 US disclosed
EP-0418845-A1 Pyrazole derivatives, processes for preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-03-27 EP disclosed