SCHEMBL11240145

SCHEMBL11240145

N=C1C(Cl)=CC(=O)C=C1NC(N)=O

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.36
▸ CYP1A2 P05177 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
SCHEMBL11234960 0.72 PEPD (0.32) NPC1
SCHEMBL2068932 0.71 MEN1 (0.46) —
SCHEMBL5963900 0.67 ALDH1A1 (0.34) NPC1
SCHEMBL15426748 0.63 TDP1 (0.44) NPC1
SCHEMBL11231048 0.63 PEPD (0.31) NPC1
SCHEMBL11241554 0.61 GAA (0.34) —
SCHEMBL2891974 0.58 NPC1 (0.61) NPC1
SCHEMBL1787750 0.57 PEPD (0.56) NPC1
SCHEMBL29537172 0.56 CYP1A2 (0.75) NPC1CYP1A2
SCHEMBL2175829 0.56 CYP1A2 (0.75) NPC1CYP1A2

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-4361516-A N-Monosubstituted indoanilines SOCIETE ANONYME DITE: L'OREAL (FR) 1982-11-30 — — US disclosed
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