SCHEMBL6189510

SCHEMBL6189510

COc1ccc2c(c1Cl)CNCC2

nearest known ligand 0.79

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 6/20 0.79
HTR2B P41595 6/20 0.79
HTR2A P28223 5/20 0.79
PNMT P11086 6/20 0.62
ADRA2A P08913 1/20 0.62
ADRA2B P18089 1/20 0.62
ADRA2C P18825 1/20 0.62

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
SCHEMBL11322725 0.90 HTR2C (0.65) HTR2CHTR2BHTR2APNMTADRA2A
SCHEMBL21762550 0.88 HTR2C (1.00) HTR2CHTR2BHTR2APNMTADRA2A
SCHEMBL3776258 0.87 HTR2C (0.79) HTR2CHTR2BHTR2APNMTADRA2A
Hydrochloric Acid SCHEMBL21753252 0.87 HTR2C (0.97) HTR2CHTR2BHTR2APNMTADRA2A
SCHEMBL30471722 0.87 HTR2C (0.79) HTR2CHTR2BHTR2APNMTADRA2A
SCHEMBL31463205 0.84 HTR2C (0.60) HTR2CHTR2BHTR2APNMTADRA2A
Hydrochloric Acid SCHEMBL31084068 0.83 HTR2C (0.58) HTR2CHTR2BHTR2APNMTADRA2A
SCHEMBL5022472 0.81 PNMT (0.59) HTR2CHTR2BHTR2APNMTADRA2A
SCHEMBL6187571 0.80 PNMT (0.57) HTR2CHTR2BHTR2APNMTADRA2A
SCHEMBL16210119 0.80 PNMT (0.57) HTR2CHTR2BHTR2APNMTADRA2A

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-0994862-B1 SULPHONAMIDE DERIVATIVES BEING 5-HT6 RECEPTOR ANTAGONISTS AND PROCESS FOR THEIR PREPARATION SMITHKLINE BEECHAM PLC (GB) 2005-06-01 EP disclosed