SCHEMBL9201599

SCHEMBL9201599

CSc1ccc(-c2cc(C(=O)O)nn2-c2ccncc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RPA1 P27694 6/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
L3MBTL1 Q9Y468 1/20 0.55
PPP1CA P62136 3/20 0.55
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
ATM Q13315 1/20 0.52
MDM2 Q00987 6/20 0.52
MCL1 Q07820 6/20 0.52
BCL2 P10415 5/20 0.52

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
SCHEMBL9209855 0.89 PTGS1 (0.46) RPA1SMN1; SMN2L3MBTL1PPP1CAMEN1
SCHEMBL9204760 0.86 KMT2A (0.72) RPA1SMN1; SMN2L3MBTL1PPP1CAMEN1
SCHEMBL9204658 0.86 KMT2A (0.72) RPA1SMN1; SMN2L3MBTL1PPP1CAMEN1
SCHEMBL7463244 0.84 RPA1 (0.76) RPA1SMN1; SMN2L3MBTL1PPP1CAMDM2
SCHEMBL8641975 0.83 RPA1 (0.67) RPA1SMN1; SMN2L3MBTL1PPP1CAMEN1
Hydrochloric Acid SCHEMBL9209971 0.83 CA9 (0.56) MEN1KMT2AMDM2MCL1BCL2
SCHEMBL8638380 0.82 RPA1 (0.55) RPA1SMN1; SMN2L3MBTL1PPP1CAMEN1
SCHEMBL9208255 0.81 RPA1 (0.57) RPA1SMN1; SMN2L3MBTL1PPP1CAMEN1
SCHEMBL1987609 0.81 RPA1 (0.82) RPA1SMN1; SMN2L3MBTL1PPP1CAMEN1
SCHEMBL3876516 0.78 RPA1 (0.56) RPA1SMN1; SMN2L3MBTL1PPP1CAMEN1

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