SCHEMBL6633692

SCHEMBL6633692

COc1ccc2cccc3c2c1C(CNC(C)=O)CC3

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 19/20 1.00
MTNR1A P48039 18/20 1.00
HTR2C P28335 2/20 0.56

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
SCHEMBL6635577 0.89 MTNR1B (1.00) MTNR1BMTNR1AHTR2C
SCHEMBL6633694 0.88 MTNR1B (1.00) MTNR1BMTNR1A
SCHEMBL6631892 0.87 MTNR1B (1.00) MTNR1BMTNR1AHTR2C
SCHEMBL6632967 0.87 MTNR1B (1.00) MTNR1BMTNR1A
SCHEMBL7743388 0.82 MTNR1B (0.70) MTNR1BMTNR1A
SCHEMBL6634020 0.82 MTNR1A (1.00) MTNR1BMTNR1A
SCHEMBL6634692 0.80 MTNR1B (1.00) MTNR1BMTNR1A
SCHEMBL6636372 0.79 MTNR1B (0.66) MTNR1BMTNR1A
SCHEMBL6634273 0.79 MTNR1B (0.81) MTNR1BMTNR1A
SCHEMBL7740272 0.79 HTR1A (0.66) MTNR1BMTNR1AHTR2C

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1047664-B1 NOVEL TRICYCLIC COMPOUNDS, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SERVIER LAB (FR) 2004-05-19 EP claimed
US-6423870-B1 ANTICOAGULANTS; CIRCADIAN RHYTHM DISORDERS; SLEEP DISORDERS LES LABORATOIRES SERVIER (FR) 2002-07-23 US claimed
EP-1047664-B1 NOVEL TRICYCLIC COMPOUNDS, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SERVIER LAB (FR) 2004-05-19 EP disclosed
US-6423870-B1 ANTICOAGULANTS; CIRCADIAN RHYTHM DISORDERS; SLEEP DISORDERS LES LABORATOIRES SERVIER (FR) 2002-07-23 US disclosed