SCHEMBL3369107

SCHEMBL3369107

CS(=O)(=O)Cc1csc(-c2ncc(C#N)cc2O)n1.c1cc2ccc1-2

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 16/20 0.63
▸ S100A9 P06702 2/20 0.36
▸ ADORA1 P30542 2/20 0.34

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
SCHEMBL3368515 0.82 EGLN1 (0.65) EGLN1S100A9
SCHEMBL3369100 0.81 EGLN1 (0.66) EGLN1S100A9
SCHEMBL3369495 0.79 EGLN1 (0.70) EGLN1S100A9
SCHEMBL3371933 0.79 EGLN1 (0.66) EGLN1S100A9
SCHEMBL3368158 0.78 EGLN1 (1.00) EGLN1
SCHEMBL3369829 0.76 EGLN1 (0.71) EGLN1
SCHEMBL3368004 0.75 EGLN1 (0.75) EGLN1
SCHEMBL3368397 0.73 EGLN1 (0.71) EGLN1
SCHEMBL3367930 0.72 EGLN1 (1.00) EGLN1
SCHEMBL3369243 0.72 EGLN1 (0.96) EGLN1

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
WO-2010018458-A2 PHENOL DERIVATIVES AND METHODS OF USE THEREOF CRYSTALGENOMICS, INC. (KR) 2010-02-18 — — WO claimed
WO-2010018458-A2 PHENOL DERIVATIVES AND METHODS OF USE THEREOF CRYSTALGENOMICS, INC. (KR) 2010-02-18 — — WO disclosed
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