SCHEMBL16477138

SCHEMBL16477138

CN1CCCc2c(c3ccc(-n4ccc(-c5ccc(CF)nn5)cc4=O)cc3n2C)C1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 20/20 0.76
CYP3A4 P08684 1/20 0.48

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
SCHEMBL12927609 0.88 MCHR1 (0.78) MCHR1CYP3A4
SCHEMBL12949731 0.86 MCHR1 (1.00) MCHR1
Hydrochloric Acid SCHEMBL1040679 0.85 MCHR1 (0.98) MCHR1
SCHEMBL11428567 0.82 MCHR1 (0.69) MCHR1CYP3A4
Hydrochloric Acid SCHEMBL3477095 0.81 MCHR1 (0.68) MCHR1CYP3A4
SCHEMBL15889530 0.77 MCHR1 (0.62) MCHR1
SCHEMBL12927524 0.76 MCHR1 (0.61) MCHR1
SCHEMBL1004038 0.76 MCHR1 (0.81) MCHR1
SCHEMBL15889575 0.76 MCHR1 (0.70) MCHR1CYP3A4
SCHEMBL12954572 0.75 MCHR1 (0.81) 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