SCHEMBL6232711

SCHEMBL6232711

O=c1c2sc(-c3ccc(Cl)cc3)cc2ncn1-c1ccc2c(c1)NCC(CN1CCCC1)O2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 20/20 1.00

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
SCHEMBL6234133 0.87 MCHR1 (1.00) MCHR1
SCHEMBL5936060 0.86 MCHR1 (1.00) MCHR1
SCHEMBL5936071 0.86 MCHR1 (1.00) MCHR1
SCHEMBL5936044 0.80 MCHR1 (0.88) MCHR1
SCHEMBL6232714 0.77 MCHR1 (0.72) MCHR1
SCHEMBL6235037 0.76 MCHR1 (0.81) MCHR1
SCHEMBL5936170 0.75 MCHR1 (1.00) MCHR1
SCHEMBL5936025 0.75 MCHR1 (0.98) MCHR1
SCHEMBL6234651 0.75 MCHR1 (1.00) MCHR1
SCHEMBL5936181 0.74 MCHR1 (1.00) 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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