SCHEMBL21185807

SCHEMBL21185807

Cc1cc(O)c2c(c1O)SC(=C1C(=O)N(CCCC#N)N(CCCC#N)C1=O)S2

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 1/20 0.30
▸ CA9 Q16790 1/20 0.30

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
SCHEMBL21185799 0.85 TYR (0.36) —
SCHEMBL25543084 0.74 HTT (0.36) —
SCHEMBL21185464 0.69 TYR (0.35) CA9
SCHEMBL21185416 0.67 MGLL (0.39) —
SCHEMBL21185802 0.66 TXNRD1 (0.31) —
SCHEMBL21185812 0.66 CGAS (0.36) —
SCHEMBL21185510 0.66 CISD1 (0.33) —
SCHEMBL21185519 0.63 — —
SCHEMBL21185523 0.63 AURKA (0.31) —
SCHEMBL21185520 0.63 HSD17B3 (0.38) —

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
WO-2019142538-A1 COMPOSITION, CURABLE COMPOSITION, AND COMPOUND 富士フイルム株式会社 2019-07-25 — — WO disclosed
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