SCHEMBL14874804

SCHEMBL14874804

Cc1ncccc1Oc1ccc(NC(=O)Oc2cn(C)c3ccccc23)cn1

nearest known ligand 0.78

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 20/20 0.78
HTR2B P41595 8/20 0.52
HTR2A P28223 3/20 0.47

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
SCHEMBL4228609 0.87 HTR2C (1.00) HTR2CHTR2BHTR2A
SCHEMBL14874790 0.83 HTR2C (0.75) HTR2CHTR2B
SCHEMBL14874775 0.82 HTR2C (0.74) HTR2CHTR2B
SCHEMBL6582412 0.80 HTR2C (0.59) HTR2CHTR2BHTR2A
SCHEMBL14874822 0.80 HTR2C (0.74) HTR2CHTR2BHTR2A
SCHEMBL14874820 0.80 HTR2C (0.74) HTR2CHTR2BHTR2A
SCHEMBL14874859 0.76 HTR2C (0.76) HTR2CHTR2BHTR2A
SCHEMBL14874784 0.76 HTR2C (0.61) HTR2CHTR2BHTR2A
SCHEMBL14874715 0.75 HTR2C (0.73) HTR2CHTR2BHTR2A
SCHEMBL14874760 0.75 HTR2C (0.62) HTR2CHTR2BHTR2A

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
EP-2108649-B1 Novel indol carboxylic acid bispyridyl carboxamide derivatives as 5-HT2c receptor antagonists KOREA RES INST CHEM TECH (KR) 2013-04-24 EP claimed