SCHEMBL20355295

SCHEMBL20355295

O=[SH](=O)c1c[nH]c2c(C(F)(F)F)c(Cl)ccc12

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 3/20 0.35
▸ CSNK2A2 P19784 2/20 0.32
▸ CSNK2B P67870 2/20 0.32
▸ CSNK2A1 P68400 2/20 0.32

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
SCHEMBL20355040 0.79 GPR17 (0.38) CSNK2A2CSNK2BCSNK2A1
SCHEMBL20354734 0.76 CSNK2A2 (0.34) CSNK2A2CSNK2BCSNK2A1
SCHEMBL21569548 0.74 NOTUM (0.34) NOTUMCSNK2A2CSNK2BCSNK2A1
SCHEMBL20354849 0.72 AR (0.47) CSNK2A2CSNK2BCSNK2A1
SCHEMBL20355225 0.72 ALDH1A1 (0.37) CSNK2A2CSNK2BCSNK2A1
SCHEMBL21569511 0.65 HSD17B10 (0.53) —
SCHEMBL20355273 0.62 TNF (0.48) NOTUMCSNK2A1
SCHEMBL17027274 0.62 IDO1 (0.48) —
SCHEMBL20354815 0.61 GPR84 (0.53) —
SCHEMBL4921456 0.59 NOTUM (0.45) NOTUM

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-2018122232-A1 (AZA)INDOLE-, BENZOTHIOPHENE-, AND BENZOFURAN-3-SULFONAMIDES UCB PHARMA GMBH (DE) 2018-07-05 — — WO disclosed
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