SCHEMBL25813207

SCHEMBL25813207

Cc1nc(-c2ccc3ccnc(NCCC(=O)Nc4nc(C)c(C(=O)OC(C)(C)C)s4)c3c2)no1

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ KIFC1 Q9BW19 20/20 0.55

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
SCHEMBL25261989 0.92 KIFC1 (0.58) KIFC1
SCHEMBL25290158 0.91 KIFC1 (0.67) KIFC1
SCHEMBL25813063 0.90 KIFC1 (0.55) KIFC1
SCHEMBL25813094 0.89 KIFC1 (0.53) KIFC1
SCHEMBL25254871 0.89 KIFC1 (0.68) KIFC1
SCHEMBL25813032 0.88 KIFC1 (0.54) KIFC1
SCHEMBL25813016 0.88 KIFC1 (0.53) KIFC1
SCHEMBL25254581 0.87 KIFC1 (0.47) KIFC1
SCHEMBL30497210 0.87 KIFC1 (0.44) KIFC1
SCHEMBL30497138 0.87 KIFC1 (0.44) KIFC1

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-2023131690-A1 SUBSTITUTED HETEROCYCLES AS HSET INHIBITORS MERCK PATENT GMBH (DE) 2023-07-13 — — WO disclosed
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