SCHEMBL30317652

SCHEMBL30317652

CCCCCCc1ccc(C(=O)NCc2c[nH]nc2-c2cccc(Cl)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 4/20 0.47
HDAC3 O15379 4/20 0.43
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
NLRP1 Q9C000 1/20 0.43
PLK1 P53350 2/20 0.43
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
MCHR1 Q99705 1/20 0.41
ROCK2 O75116 1/20 0.40
ROCK1 Q13464 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
SCHEMBL28986015 1.00 TRPV1 (0.47) TRPV1HDAC3LMNAMAPK1NLRP1
SCHEMBL30317488 0.89 TRPV1 (0.47) TRPV1HDAC3PLK1
SCHEMBL28986043 0.89 TRPV1 (0.47) TRPV1HDAC3PLK1
SCHEMBL28986038 0.89 TRPV1 (0.47) TRPV1LMNAMAPK1NLRP1MCHR1
SCHEMBL28985996 0.88 TRPV1 (0.52) TRPV1HDAC3PLK1HDAC1HDAC2
SCHEMBL28986055 0.88 TRPV1 (0.52) TRPV1HDAC3PLK1HDAC1HDAC2
SCHEMBL28985995 0.88 TRPV1 (0.52) TRPV1HDAC3PLK1HDAC1HDAC2
SCHEMBL28986005 0.87 TRPV1 (0.53) TRPV1HDAC3PLK1HDAC1HDAC2
SCHEMBL28986000 0.84 TRPV1 (0.50) TRPV1HDAC3LMNAPLK1HDAC1
SCHEMBL28986054 0.83 TRPV1 (0.47) TRPV1PLK1MCHR1

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-115960047-B 3-Phenyl-1H-pyrazole compound and application thereof 中国药科大学 2025-04-15 CN disclosed
CN-115960047-A 3-phenyl-1H-pyrazole compound and application thereof 中国药科大学 2023-04-14 CN disclosed