SCHEMBL6557622

SCHEMBL6557622

CN(CCC1CCCO1)c1ccc2cc(NC(=O)CCc3ccc(C(F)(F)F)cc3)ccc2n1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 20/20 0.72

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
SCHEMBL5873682 0.84 MCHR1 (0.73) MCHR1
SCHEMBL5873539 0.84 MCHR1 (0.98) MCHR1
SCHEMBL5873754 0.84 MCHR1 (1.00) MCHR1
SCHEMBL5873509 0.83 MCHR1 (1.00) MCHR1
SCHEMBL5873636 0.83 MCHR1 (0.87) MCHR1
SCHEMBL5873536 0.81 MCHR1 (0.80) MCHR1
SCHEMBL5873533 0.81 MCHR1 (0.80) MCHR1
SCHEMBL5873758 0.79 MCHR1 (1.00) MCHR1
SCHEMBL5873666 0.76 MCHR1 (0.86) MCHR1
SCHEMBL5873529 0.74 MCHR1 (0.82) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1450801-A2 2-AMINOQUINOLINE COMPOUNDS Merck & Co., Inc. (US) 2004-09-01 EP claimed
WO-2003045313-A2 2-AMINOQUINOLINE COMPOUNDS MERCK & CO. INC. (US) 2003-06-05 WO claimed