SCHEMBL9201596

SCHEMBL9201596

CSc1ccc(-c2cc(C(=O)N3CCCC3)nn2-c2ccc(F)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 2/20 0.65
PTGS2 P35354 5/20 0.57
CHRNA7 P36544 2/20 0.55
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
MAPT P10636 2/20 0.53
KDM1A O60341 2/20 0.52
ATM Q13315 1/20 0.51
MGLL Q99685 3/20 0.51
NPC1 O15118 1/20 0.47
TP53 P04637 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
PPP1CA P62136 1/20 0.47

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
SCHEMBL16640301 0.84 MALT1 (0.67) MALT1PTGS2CHRNA7MEN1KMT2A
SCHEMBL9204658 0.84 KMT2A (0.72) PTGS2CHRNA7MEN1KMT2AATM
SCHEMBL9204760 0.84 KMT2A (0.72) PTGS2CHRNA7MEN1KMT2AATM
SCHEMBL9201626 0.84 PTGS2 (0.67) MALT1PTGS2CHRNA7
SCHEMBL16640303 0.83 MALT1 (0.65) MALT1PTGS2CHRNA7MEN1KMT2A
SCHEMBL9209766 0.83 MEN1 (0.56) MALT1PTGS2CHRNA7MEN1KMT2A
SCHEMBL9199551 0.83 MEN1 (0.56) MALT1PTGS2CHRNA7MEN1KMT2A
SCHEMBL9207456 0.83 KMT2A (0.59) MALT1PTGS2CHRNA7MEN1KMT2A
SCHEMBL9208842 0.81 MALT1 (0.65) MALT1PTGS2CHRNA7MEN1KMT2A
SCHEMBL3865146 0.81 PTGS2 (0.69) MALT1PTGS2CHRNA7MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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