SCHEMBL31438299

SCHEMBL31438299

O=S(=O)(Cl)c1c[nH]c2c(-c3nnco3)c(Cl)ccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ NOTUM Q6P988 7/20 0.35
▸ CYP3A4 P08684 2/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ PSEN1 P49768 1/20 0.34
▸ PSEN2 P49810 1/20 0.34
▸ APH1B Q8WW43 1/20 0.34
▸ NCSTN Q92542 1/20 0.34
▸ APH1A Q96BI3 1/20 0.34
▸ PSENEN Q9NZ42 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ GAA P10253 1/20 0.31

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
SCHEMBL31438290 0.80 KDM5A (0.32) —
SCHEMBL31438300 0.78 CYP3A4 (0.34) NOTUMCYP3A4CYP2D6PSEN1PSEN2
SCHEMBL31319636 0.75 PRMT5 (0.33) —
SCHEMBL31438255 0.75 — —
SCHEMBL31438267 0.74 MET (0.33) CA12CA1CA2CA9ALDH1A1
SCHEMBL31438244 0.73 SCN9A (0.31) —
SCHEMBL31438294 0.73 NOTUM (0.33) NOTUMALDH1A1GAA
SCHEMBL30752365 0.73 CLK1 (0.38) CA12CA1CA2CA9ALDH1A1
SCHEMBL31438304 0.73 CYP3A4 (0.32) CYP3A4CYP2D6
SCHEMBL31438257 0.72 CCR9 (0.30) —

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-119585257-A Novel 7-substituted indole sulfonamide derivatives 豪夫迈·罗氏有限公司 2025-03-07 — — CN disclosed
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