SCHEMBL16477202

SCHEMBL16477202

Cn1c2c(c3ccc(Br)cc31)CNCCC2

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 18/20 0.51

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
SCHEMBL21088048 0.92 MCHR1 (0.53) MCHR1
SCHEMBL3477565 0.83 MCHR1 (0.51) MCHR1
SCHEMBL9966179 0.82 ALOX5 (0.53)
SCHEMBL12927722 0.81 ALOX5 (0.55)
Trifluoroacetic Acid SCHEMBL29984059 0.80 MCHR1 (0.50) MCHR1
Trifluoroacetic Acid SCHEMBL27081951 0.80 MCHR1 (0.50) MCHR1
SCHEMBL21088049 0.80 HTR2A (0.50) MCHR1
SCHEMBL10154860 0.80 HTR2A (0.65) MCHR1
SCHEMBL15977193 0.75 MCHR1 (0.54) MCHR1
SCHEMBL21153968 0.74 MCHR1 (0.53) MCHR1

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
EP-2448585-B1 AZINONE-SUBSTITUTED AZEPINO[B]INDOLE AND PYRIDO-PYRROLO-AZEPINE MCH-1 ANTAGONISTS, METHODS OF MAKING, AND USE THEREOF ALBANY MOLECULAR RES INC (US) 2014-01-01 EP disclosed