SCHEMBL6299752

SCHEMBL6299752

CC[C@H]1CNCCc2cc(Cl)c(Cl)cc21

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 17/20 0.68
HTR2A P28223 16/20 0.68
HTR2B P41595 16/20 0.68
ADRB1 P08588 1/20 0.43
HTR1A P08908 1/20 0.43
ADRA2A P08913 1/20 0.43
ADRA2B P18089 1/20 0.43
ADRA2C P18825 1/20 0.43
CNR1 P21554 1/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
HRH1 P35367 1/20 0.43
KCNH2 Q12809 1/20 0.43
DRD2 P14416 2/20 0.42
DRD1 P21728 2/20 0.42

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
SCHEMBL1096338 1.00 HTR2C (0.68) HTR2CHTR2AHTR2BADRB1HTR1A
SCHEMBL6293823 1.00 HTR2C (0.68) HTR2CHTR2AHTR2BADRB1HTR1A
SCHEMBL9289407 0.89 HTR2C (0.63) HTR2CHTR2AHTR2BADRB1HTR1A
SCHEMBL1095696 0.88 HTR2C (0.69) HTR2CHTR2AHTR2BADRB1HTR1A
SCHEMBL6295132 0.88 HTR2C (0.69) HTR2CHTR2AHTR2BADRB1HTR1A
SCHEMBL1094009 0.86 HTR2C (0.72) HTR2CHTR2AHTR2BDRD1
SCHEMBL1096094 0.86 HTR2C (0.72) HTR2CHTR2AHTR2BDRD1
SCHEMBL1094010 0.86 HTR2C (0.72) HTR2CHTR2AHTR2BDRD1
SCHEMBL1094635 0.81 HTR2A (1.00) HTR2CHTR2AHTR2BADRB1HTR1A
SCHEMBL1094393 0.81 HTR2A (1.00) HTR2CHTR2AHTR2BADRB1HTR1A

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-6953787-B2 5HT2C receptor modulators ARENA PHARMACEUTICALS, INC. (US) 2005-10-11 US claimed