SCHEMBL31028148

SCHEMBL31028148

N#Cc1cccc(-c2ccc(Oc3ccc(F)cc3)c(C(N)=O)c2F)c1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 14/20 0.46
▸ PTGDR2 Q9Y5Y4 2/20 0.43
▸ TBXA2R P21731 2/20 0.41
▸ BACE1 P56817 1/20 0.40
▸ IKBKB O14920 1/20 0.39
▸ CHUK O15111 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
SCHEMBL31028161 0.89 SCN9A (0.45) SCN9APTGDR2TBXA2RBACE1
SCHEMBL31028162 0.82 PARP10 (0.47) SCN9A
SCHEMBL31028187 0.81 SCN9A (0.43) SCN9A
SCHEMBL31028156 0.81 SCN9A (0.44) SCN9A
SCHEMBL31028163 0.77 PARP10 (0.42) SCN9A
SCHEMBL31028147 0.71 SCN9A (0.47) SCN9A
SCHEMBL19579269 0.71 CLK4 (0.52) —
SCHEMBL20573271 0.68 ADRA2C (0.50) PTGDR2BACE1IKBKBCHUK
SCHEMBL5225459 0.68 CDK1 (0.38) —
SCHEMBL923535 0.67 ALOX5 (0.50) —

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-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
Send feedback