SCHEMBL7247542

SCHEMBL7247542

Cc1ccc(NS(C)(=O)=O)cc1Nc1cc[nH]c1C

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.45
▸ ATM Q13315 2/20 0.43
▸ POLB P06746 1/20 0.41
▸ TNIK Q9UKE5 5/20 0.41
▸ BACE1 P56817 2/20 0.41
▸ BRD4 O60885 1/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ CCNT1 O60563 1/20 0.40
▸ CDK9 P50750 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ BRAF P15056 1/20 0.39
▸ KAT2B Q92831 1/20 0.39

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
SCHEMBL27561375 0.73 CA2 (0.42) BRD4PTGS1PTGS2
SCHEMBL27564358 0.73 PTGS1 (0.43) MAPTATMPOLBPTGS1PTGS2
SCHEMBL14414981 0.72 KAT2B (0.55) MAPTATMPOLBKAT2B
SCHEMBL11233535 0.71 PTGS1 (0.55) POLBPTGS1PTGS2KAT2B
SCHEMBL27582055 0.70 P2RX7 (0.39) POLB
SCHEMBL27564357 0.69 ALDH3A1 (0.46) MAPTKMT2ANPC1
SCHEMBL27561385 0.69 TDP1 (0.38) MAPTPTGS1PTGS2CCNT1CDK9
SCHEMBL27582103 0.69 KDR (0.40) MAPTKMT2ANPC1BRAF
SCHEMBL4164692 0.67 KAT2B (0.46) MAPTATMTNIKKAT2B
SCHEMBL14757815 0.67 KAT2B (0.46) MAPTATMPTGS1PTGS2KAT2B

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-6670357-B2 Antiinflammatory agents BRISTOL-MYERS SQUIBB COMPANY 2003-12-30 — — US disclosed
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