SCHEMBL28024587

SCHEMBL28024587

NCc1cccc(-c2ccnc(N)c2S(N)(=O)=O)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IKBKB O14920 2/20 0.41
▸ CHUK O15111 1/20 0.41
▸ LOXL2 Q9Y4K0 2/20 0.40
▸ CFD P00746 1/20 0.39
▸ ROCK1 Q13464 1/20 0.39
▸ SYK P43405 1/20 0.39
▸ MAP4K4 O95819 1/20 0.37
▸ ENPP1 P22413 1/20 0.37
▸ KARS1 Q15046 1/20 0.37
▸ CA1 P00915 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ CA4 P22748 2/20 0.36
▸ CA7 P43166 2/20 0.36
▸ ATR Q13535 1/20 0.36
▸ HTR6 P50406 1/20 0.36
▸ CDK8 P49336 1/20 0.36
▸ CA12 O43570 1/20 0.36
▸ CA6 P23280 1/20 0.36
▸ CA5A P35218 1/20 0.36
▸ CA9 Q16790 1/20 0.36

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
SCHEMBL11158123 0.81 RAB9A (0.43) IKBKBCHUKROCK1MAP4K4CA1
SCHEMBL27500767 0.75 MAP4K4 (0.65) LOXL2CFDROCK1MAP4K4
SCHEMBL15865105 0.71 CYP17A1 (0.39) IKBKBCHUKCA1CA2CA4
SCHEMBL3720559 0.67 CA2 (0.70) CA1CA2CA4CA7CA12
SCHEMBL27876845 0.67 LOXL2 (0.65) LOXL2SYKKARS1CDK8
SCHEMBL1795003 0.67 CA2 (0.64) LOXL2CA1CA2CA4CA7
SCHEMBL28799003 0.67 CYP2A6 (0.46) IKBKBCHUKLOXL2SYKMAP4K4
SCHEMBL24668682 0.67 CA1 (0.49) IKBKBCHUKCA1CA2CA4
SCHEMBL3791745 0.66 LOXL2 (0.60) LOXL2CFDCDK8
SCHEMBL24600967 0.66 PRKCI (0.47) IKBKBCHUKLOXL2SYKCDK8

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-104927742-B Polyurethane wood structure glue and preparation method thereof 上海东和胶粘剂有限公司 2017-05-17 — — CN disclosed
CN-104927742-A Polyurethane wood structure glue and preparation method thereof SHANGHAI DONGHE ADHESIVE CO LTD 2015-09-23 — — CN disclosed
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