SCHEMBL6230563

SCHEMBL6230563

Cc1nc2cc(-n3cnc4cc(-c5ccc(Cl)cc5)sc4c3=O)ccc2n1CCCN1CC[C@H](O)C1

nearest known ligand 0.74

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 20/20 0.74

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
SCHEMBL5936135 0.86 MCHR1 (0.83) MCHR1
Trifluoroacetic Acid SCHEMBL5936008 0.84 MCHR1 (0.71) MCHR1
SCHEMBL14535190 0.84 MCHR1 (0.90) MCHR1
Trifluoroacetic Acid SCHEMBL5936111 0.83 MCHR1 (0.81) MCHR1
SCHEMBL5255423 0.82 MCHR1 (0.73) MCHR1
SCHEMBL14535195 0.81 MCHR1 (0.79) MCHR1
SCHEMBL5936020 0.80 MCHR1 (0.77) MCHR1
SCHEMBL5257021 0.79 MCHR1 (0.79) MCHR1
SCHEMBL14525243 0.79 MCHR1 (0.79) MCHR1
SCHEMBL5253907 0.79 MCHR1 (0.79) 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
WO-2004092181-A9 HETEROCYCLIC MCHR1 ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2005-01-27 — — WO disclosed
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