SCHEMBL14164099

SCHEMBL14164099

NC(=O)Nc1cc(Nc2nc(F)nc(Nc3ccc(S)cc3)n2)ccc1N=Nc1ccc2c(S)cc(S)cc2c1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ KMT2A Q03164 1/20 0.31

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
SCHEMBL13604784 0.90 CA12 (0.31) —
SCHEMBL13604623 0.84 KIF11 (0.32) —
SCHEMBL14159936 0.81 MAPT (0.41) MEN1MAPTKMT2A
SCHEMBL14222100 0.73 POLB (0.32) MEN1MAPTKMT2A
SCHEMBL13611632 0.72 KCNH3 (0.33) MEN1KMT2A
SCHEMBL5839338 0.72 CD40 (0.49) —
SCHEMBL5839345 0.72 CD40 (0.49) —
SCHEMBL5839329 0.72 CD40 (0.49) —
SCHEMBL14159925 0.72 MAPT (0.36) MEN1MAPTKMT2A
SCHEMBL13604556 0.71 CA12 (0.33) MEN1MAPTKMT2A

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
US-7381256-B2 Mixtures of fiber-reactive azo dyes, their production and their use DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2008-06-03 — — US disclosed
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