SCHEMBL2575164

SCHEMBL2575164

CCc1ccc2c(c1)N1CCNCC1CCO2

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 18/20 0.53
HTR2B P41595 18/20 0.53
HTR2A P28223 9/20 0.48

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
SCHEMBL2020049 1.00 HTR2C (0.53) HTR2CHTR2BHTR2A
SCHEMBL2015254 0.87 HTR2C (0.47) HTR2CHTR2BHTR2A
SCHEMBL2576950 0.85 HTR2C (0.50) HTR2CHTR2BHTR2A
SCHEMBL2014029 0.85 HTR2C (0.50) HTR2CHTR2BHTR2A
SCHEMBL2021572 0.84 HTR2C (0.47) HTR2CHTR2BHTR2A
SCHEMBL2019564 0.84 HTR2C (0.47) HTR2CHTR2BHTR2A
SCHEMBL692581 0.84 HTR2C (0.47) HTR2CHTR2BHTR2A
SCHEMBL2018109 0.81 HTR2C (0.62) HTR2CHTR2BHTR2A
SCHEMBL2017778 0.81 HTR2C (0.58) HTR2CHTR2BHTR2A
SCHEMBL2018023 0.81 HTR2C (0.44) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2560973-A1 MODULATORS OF 5-HT RECEPTORS AND METHODS OF USE THEREOF Abbvie Inc. (US) 2013-02-27 EP disclosed
WO-2011133182-A1 MODULATORS OF 5-HT RECEPTORS AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2011-10-27 WO disclosed