SCHEMBL31533006

SCHEMBL31533006

COc1cc(/C=C/C(=O)N2CCN(S(=O)(=O)c3cccc(Cl)c3)CC2)ccc1O

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR183 P32249 2/20 0.68
KDM4E B2RXH2 1/20 0.68
ALDH1A1 P00352 1/20 0.68
ACHE P22303 8/20 0.67
ROCK2 O75116 2/20 0.61
TRPV1 Q8NER1 3/20 0.60

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
SCHEMBL31532992 0.90 GPR183 (0.74) GPR183KDM4EALDH1A1ACHEROCK2
SCHEMBL31532994 0.90 GPR183 (0.74) GPR183KDM4EALDH1A1ACHEROCK2
SCHEMBL31532986 0.89 ACHE (0.71) GPR183KDM4EALDH1A1ACHEROCK2
SCHEMBL31533002 0.89 KDM4E (0.84) GPR183KDM4EALDH1A1ACHEROCK2
SCHEMBL31532990 0.89 KDM4E (0.84) GPR183KDM4EALDH1A1ACHEROCK2
SCHEMBL31533007 0.89 GPR183 (0.71) GPR183KDM4EALDH1A1ACHEROCK2
SCHEMBL31532995 0.89 GPR183 (0.68) GPR183KDM4EALDH1A1ACHEROCK2
SCHEMBL31532998 0.89 GPR183 (0.71) GPR183KDM4EALDH1A1ACHEROCK2
SCHEMBL31532985 0.88 ACHE (0.61) GPR183KDM4EALDH1A1ACHEROCK2
SCHEMBL31533010 0.86 KDM4E (0.65) GPR183KDM4EALDH1A1ACHEROCK2

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-119930543-A Preparation method of novel ferulic acid derivative containing sulfonamide structure and application of ferulic acid derivative in agriculture 贵州工业职业技术学院 2025-05-06 CN disclosed