SCHEMBL30320960

SCHEMBL30320960

Cc1cc(NC(=O)Cc2ccc(S(C)(=O)=O)cc2)cc(C)c1-c1ccccc1OC(F)(F)F

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RORC P51449 20/20 0.81
CYP2C9 P11712 1/20 0.68
CYP2C19 P33261 1/20 0.68

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
SCHEMBL24032756 1.00 RORC (0.81) RORCCYP2C9CYP2C19
SCHEMBL14746449 0.94 RORC (0.75) RORCCYP2C9CYP2C19
SCHEMBL14747100 0.94 RORC (0.90) RORCCYP2C9CYP2C19
SCHEMBL14744409 0.90 RORC (0.81) RORCCYP2C9CYP2C19
SCHEMBL14746649 0.89 RORC (1.00) RORCCYP2C9CYP2C19
SCHEMBL30320981 0.89 RORC (1.00) RORCCYP2C9CYP2C19
SCHEMBL14754259 0.89 RORC (0.72) RORCCYP2C9CYP2C19
SCHEMBL14754274 0.86 RORC (0.82) RORCCYP2C9CYP2C19
SCHEMBL14754268 0.85 RORC (1.00) RORCCYP2C9CYP2C19
SCHEMBL24032757 0.85 RORC (0.65) RORCCYP2C9CYP2C19

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-113666853-B Biaryl compounds useful as ROR gamma modulators 上海辉启生物医药科技有限公司 2023-04-18 CN disclosed