SCHEMBL31028162

SCHEMBL31028162

NC(=O)c1c(Oc2ccc(F)cc2)ccc(-c2ccccc2)c1F

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PARP10 Q53GL7 2/20 0.47
▸ CTNNB1 P35222 1/20 0.44
▸ SCN9A Q15858 7/20 0.44
▸ NCOA1 Q15788 1/20 0.43
▸ NCOA3 Q9Y6Q9 1/20 0.43
▸ FFAR4 Q5NUL3 2/20 0.41
▸ FEN1 P39748 1/20 0.40
▸ PNLIP P16233 1/20 0.39
▸ MAP2K1 Q02750 1/20 0.39
▸ CDK1 P06493 1/20 0.39
▸ CCNB1 P14635 1/20 0.39
▸ CCNA2 P20248 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ FFAR1 O14842 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
SCHEMBL31028147 0.87 SCN9A (0.47) PARP10CTNNB1SCN9ANCOA1NCOA3
SCHEMBL31028163 0.84 PARP10 (0.42) PARP10CTNNB1SCN9ANCOA1NCOA3
SCHEMBL31028156 0.83 SCN9A (0.44) SCN9A
SCHEMBL31028148 0.82 SCN9A (0.46) SCN9A
SCHEMBL28329663 0.75 BCAT2 (0.47) FEN1CDK1CCNB1CCNA2CDK2
SCHEMBL31028187 0.73 SCN9A (0.43) PARP10SCN9AFEN1
SCHEMBL24578005 0.72 BCAT2 (0.50) PARP10CTNNB1SCN9AFFAR4FFAR1
SCHEMBL27800575 0.71 CTNNB1 (0.77) PARP10CTNNB1SCN9APNLIP
SCHEMBL31028161 0.71 SCN9A (0.45) SCN9A
SCHEMBL28500768 0.69 IKBKB (0.51) PARP10CTNNB1SCN9AFFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113646299-B Novel N-benzyl-2-phenoxybenzamide derivatives as prostaglandin E2 (PGE 2) receptor modulators 梅迪比奥法尔玛公司 2024-07-26 — — CN claimed
CN-113646299-B Novel N-benzyl-2-phenoxybenzamide derivatives as prostaglandin E2 (PGE 2) receptor modulators 梅迪比奥法尔玛公司 2024-07-26 — — CN disclosed
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