SCHEMBL16477308

SCHEMBL16477308

Cc1ccc(COc2ccn(-c3ccc4c5c(n(C)c4c3)CCNCC5)c(=O)c2)c(F)c1

nearest known ligand 0.86

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 20/20 0.86
CYP3A4 P08684 1/20 0.61

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
SCHEMBL12927862 0.92 MCHR1 (1.00) MCHR1CYP3A4
Hydrochloric Acid SCHEMBL1004713 0.92 MCHR1 (0.98) MCHR1CYP3A4
SCHEMBL12949838 0.91 MCHR1 (0.84) MCHR1CYP3A4
SCHEMBL12927870 0.91 MCHR1 (1.00) MCHR1CYP3A4
Hydrochloric Acid SCHEMBL1007067 0.90 MCHR1 (0.98) MCHR1CYP3A4
SCHEMBL16477206 0.90 MCHR1 (0.86) MCHR1CYP3A4
SCHEMBL12927873 0.84 MCHR1 (1.00) MCHR1CYP3A4
SCHEMBL1004550 0.84 MCHR1 (1.00) MCHR1CYP3A4
SCHEMBL12927843 0.84 MCHR1 (0.83) MCHR1CYP3A4
Hydrochloric Acid SCHEMBL1004830 0.83 MCHR1 (0.98) MCHR1CYP3A4

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