SCHEMBL8628005

SCHEMBL8628005

Cc1ccc(-c2c(NS(=O)(=O)c3ccccc3)nn(C)c2C(F)(F)F)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
NPY5R Q15761 1/20 0.42
CA12 O43570 2/20 0.42
CA2 P00918 2/20 0.42
CA9 Q16790 2/20 0.42
CA1 P00915 1/20 0.42
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MCL1 Q07820 1/20 0.40
FFAR1 O14842 1/20 0.40
CDK1 P06493 1/20 0.40
CCNB1 P14635 1/20 0.40
CCNA2 P20248 1/20 0.40
CDK2 P24941 1/20 0.40
CDK7 P50613 1/20 0.40
CCNH P51946 1/20 0.40
CCNA1 P78396 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40

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
SCHEMBL8629978 0.93 MAPT (0.43) MAPTKMT2AMEN1ALDH1A1FFAR4
SCHEMBL8631516 0.91 PTGS2 (0.46) MAPTKMT2AMEN1PTGS1PTGS2
SCHEMBL8632451 0.90 KDM1A (0.45) KMT2AMEN1ALDH1A1KDM4EHDAC4
SCHEMBL8629307 0.88 GAA (0.47) MAPTNPY5RKMT2AMEN1ALDH1A1
SCHEMBL8632194 0.88 KMT2A (0.40) MAPTKMT2AMEN1ALDH1A1PTGS1
SCHEMBL8631851 0.86 MAPT (0.39) MAPTKMT2AMEN1ALDH1A1FFAR4
SCHEMBL8630021 0.85 SMN1; SMN2 (0.49) MAPTNPY5RCA12CA2CA9
SCHEMBL8632849 0.84 MAPT (0.39) MAPTKMT2AMEN1FFAR4PTGS1
SCHEMBL8629928 0.84 PTGS2 (0.43) MAPTNPY5RCA12CA9KMT2A
SCHEMBL8629730 0.83 MAPT (0.45) MAPTNPY5RKMT2AMEN1TDP1

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
US-5756530-A NON-STEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS G. D. SEARLE & CO. (US) 1998-05-26 US disclosed