SCHEMBL31331822

SCHEMBL31331822

Cc1ccc(S(N)(=O)=O)cc1-c1cn(C)cn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 5/20 0.43
▸ PIK3CG P48736 5/20 0.43
▸ PIK3CB P42338 3/20 0.43
▸ PIK3C3 Q8NEB9 2/20 0.43
▸ LRRK2 Q5S007 3/20 0.41
▸ TEAD1 P28347 1/20 0.41
▸ YAP1 P46937 1/20 0.41
▸ CA1 P00915 6/20 0.41
▸ CA2 P00918 6/20 0.41
▸ CA5A P35218 1/20 0.41
▸ CA5B Q9Y2D0 1/20 0.41
▸ MTOR P42345 1/20 0.41
▸ CA9 Q16790 6/20 0.40
▸ CA12 O43570 5/20 0.40
▸ CYP2E1 P05181 1/20 0.38
▸ CYP2A6 P11509 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2B6 P20813 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ PTGES O14684 1/20 0.38

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
SCHEMBL29602351 0.75 BRD4 (0.53) PIK3CDPIK3CGPIK3CBCA1CA2
SCHEMBL28732947 0.75 BRD4 (0.53) PIK3CDPIK3CGPIK3CBCA1CA2
SCHEMBL22843343 0.74 TEAD1 (0.48) PIK3CDPIK3CGTEAD1YAP1CA9
SCHEMBL22718321 0.74 LMNA (0.46) TEAD1YAP1CA1CA2CA9
SCHEMBL29704124 0.73 CA2 (0.51) LRRK2CA1CA2CA9CA12
SCHEMBL22635577 0.73 CYP2C9 (0.43) PIK3CDLRRK2CA1CA2CA5A
SCHEMBL22718340 0.72 LRRK2 (0.40) PIK3CDLRRK2CA1CA2CA9
SCHEMBL29704120 0.72 LRRK2 (0.40) PIK3CDLRRK2CA1CA2CA9
SCHEMBL15829876 0.71 CYP1A2 (0.49) LRRK2CYP2E1CYP2A6CYP2C9CYP2B6
SCHEMBL24669566 0.70 CA2 (0.46) PIK3CDPIK3CGPIK3CBPIK3C3LRRK2

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-119954725-A TEAD inhibitors and uses thereof 医肯纳肿瘤学公司 2025-05-09 — — CN disclosed
CN-114466839-B TEAD inhibitors and uses thereof 医肯纳肿瘤学公司 2025-01-07 — — CN disclosed
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