SCHEMBL27524809

SCHEMBL27524809

CC(=O)c1ccc(-c2cc(C(=O)O)nn2-c2ccc(F)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.74
MEN1 O00255 2/20 0.74
ATM Q13315 1/20 0.73
PPP1CA P62136 2/20 0.66
RPA1 P27694 6/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
L3MBTL1 Q9Y468 1/20 0.55
MARS1 P56192 1/20 0.54
CHRNA7 P36544 1/20 0.53
PTGS2 P35354 1/20 0.53
BCL2 P10415 3/20 0.52
MDM2 Q00987 3/20 0.52
MCL1 Q07820 3/20 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
SCHEMBL9209895 0.89 MEN1 (0.57) KMT2AMEN1ATMPPP1CARPA1
SCHEMBL9207808 0.87 KMT2A (0.78) KMT2AMEN1ATMPPP1CARPA1
SCHEMBL1514409 0.85 KMT2A (1.00) KMT2AMEN1ATMPPP1CARPA1
SCHEMBL27714729 0.85 KMT2A (0.89) KMT2AMEN1ATMPPP1CARPA1
SCHEMBL4493013 0.84 KMT2A (1.00) KMT2AMEN1ATMPPP1CARPA1
SCHEMBL27422557 0.84 KMT2A (0.78) KMT2AMEN1ATMPPP1CARPA1
SCHEMBL9204760 0.84 KMT2A (0.72) KMT2AMEN1ATMPPP1CARPA1
SCHEMBL9204658 0.84 KMT2A (0.72) KMT2AMEN1ATMPPP1CARPA1
SCHEMBL9203093 0.83 CHRNA7 (0.72) KMT2AMEN1ATMPPP1CACHRNA7
SCHEMBL9203245 0.82 MEN1 (0.70) KMT2AMEN1ATMPPP1CARPA1

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 1 patent. 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