SCHEMBL19003857

SCHEMBL19003857

C=CC(/C=C/c1ccc(N(CCO)CCO)cc1)=C\C=N\CCO

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.30
▸ GAA P10253 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
SCHEMBL16997447 0.93 — —
SCHEMBL23787807 0.88 KDM4A (0.33) —
SCHEMBL18774292 0.85 CHRM2 (0.35) —
SCHEMBL17001516 0.84 NPC1 (0.34) NPC1GAA
SCHEMBL19903948 0.75 HSD17B3 (0.42) NPC1
SCHEMBL19903953 0.74 — —
SCHEMBL14817853 0.73 MAPK1 (0.33) NPC1GAA
SCHEMBL7718268 0.71 APP (0.42) NPC1GAA
SCHEMBL9915630 0.71 APP (0.42) NPC1GAA
SCHEMBL9915609 0.71 APP (0.42) NPC1GAA

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-2017103038-A2 COMPOSITION FOR DYEING KERATIN FIBRES, COMPRISING A STYRYL OR NAPHTHYLAMIDE DIRECT DYE BEARING A HYDROXYALKYL FUNCTION, DYEING PROCESS AND DYE L'OREAL (FR) 2017-06-22 — — WO disclosed
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