SCHEMBL7189957

SCHEMBL7189957

C1=Cc2cccc(CCc3cccc4c3CC=C4)c2C1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.36
HTR2A P28223 1/20 0.36
SLC6A4 P31645 1/20 0.36
HRH1 P35367 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
HTR2B P41595 1/20 0.36
HTR3A P46098 1/20 0.36
SLC6A3 Q01959 1/20 0.36

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
SCHEMBL12319673 0.88 TAAR1 (0.40) SLC6A2HTR2ASLC6A4HRH1OPRD1
SCHEMBL6912026 0.88 HTR2A (0.34) SLC6A2HTR2ASLC6A4HRH1OPRD1
SCHEMBL7185336 0.87 SLC6A2 (0.36) SLC6A2HTR2ASLC6A4HRH1OPRD1
SCHEMBL6913429 0.85 LIPG (0.35) SLC6A2HTR2ASLC6A4HRH1OPRD1
SCHEMBL24336044 0.85 TAAR1 (0.41) SLC6A2HTR2ASLC6A4HRH1OPRD1
SCHEMBL14646043 0.84 LIPG (0.41)
SCHEMBL24336300 0.83 TAAR1 (0.40) SLC6A2HTR2ASLC6A4HRH1OPRD1
SCHEMBL1319130 0.83 SLC6A2 (0.35) SLC6A2HTR2ASLC6A4HRH1OPRD1
SCHEMBL6912491 0.83 GABRA1 (0.40) SLC6A2HTR2ASLC6A4HRH1OPRD1
SCHEMBL12319674 0.83 SLC6A2 (0.35) SLC6A2HTR2ASLC6A4HRH1OPRD1

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-1034190-B1 POLYMERIZATION CATALYST FOR OLEFIN MONOMERS LG CHEMICAL LTD (KR) 2003-08-27 EP disclosed