SCHEMBL7740248

SCHEMBL7740248

COc1ccc2occ3c2c1CCC3CCN

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.56
MTNR1A P48039 9/20 0.41
MTNR1B P49286 9/20 0.41
ADRA1A P35348 1/20 0.38

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
SCHEMBL7741698 0.90 HTR1A (0.65) HTR1AMTNR1AMTNR1BADRA1A
SCHEMBL7741709 0.80 HTR1A (0.81) HTR1AMTNR1AMTNR1B
SCHEMBL7735727 0.78 MTNR1A (0.65) HTR1AMTNR1AMTNR1B
SCHEMBL6636125 0.76 MTNR1A (0.67) MTNR1AMTNR1B
SCHEMBL7741701 0.75 HTR1A (0.44) HTR1AMTNR1AMTNR1BADRA1A
Hydrochloric Acid SCHEMBL7743440 0.75 MTNR1A (0.65) MTNR1AMTNR1B
SCHEMBL7741773 0.75 MTNR1A (0.65) MTNR1AMTNR1B
SCHEMBL6635793 0.74 MTNR1B (0.65) HTR1AMTNR1AMTNR1B
SCHEMBL7740358 0.73 MTNR1A (0.41) HTR1AMTNR1AMTNR1B
SCHEMBL6633828 0.72 MTNR1A (0.58) MTNR1AMTNR1B

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
US-6423870-B1 ANTICOAGULANTS; CIRCADIAN RHYTHM DISORDERS; SLEEP DISORDERS LES LABORATOIRES SERVIER (FR) 2002-07-23 US disclosed