SCHEMBL7741706

SCHEMBL7741706

NCCC1CCc2coc3ccc(Cl)c1c23

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.53

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
SCHEMBL7741709 0.81 HTR1A (0.81) HTR1A
SCHEMBL7741724 0.70 HTR1A (0.67) HTR1A
SCHEMBL7743293 0.69 HTR1A (1.00) HTR1A
SCHEMBL1515683 0.68 HTR1A (0.40) HTR1A
SCHEMBL13983937 0.68 HTR1A (0.40) HTR1A
SCHEMBL7740248 0.65 HTR1A (0.56) HTR1A
SCHEMBL7410004 0.60 ESR1 (0.62)
SCHEMBL340076 0.59 MTNR1A (0.62)
SCHEMBL11917773 0.59 MTNR1A (0.62)
SCHEMBL340075 0.59 MTNR1A (0.62)

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