SCHEMBL3375968

SCHEMBL3375968

CCCCc1ccc(N(c2ccc(CCCC)cc2)c2cccc(Cc3ccccc3)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.45
OPRM1 P35372 3/20 0.44
DRD3 P35462 3/20 0.44
KCNH2 Q12809 2/20 0.44
CHRM2 P08172 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
CHRM1 P11229 1/20 0.44
DRD1 P21728 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
ADRA1A P35348 1/20 0.44
SLC6A3 Q01959 1/20 0.44
GRM2 Q14416 1/20 0.42
DRD2 P14416 2/20 0.40
OPRD1 P41143 2/20 0.40
OPRK1 P41145 2/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
HSD11B1 P28845 1/20 0.40

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
SCHEMBL10042890 0.89 BCHE (0.47) BCHEOPRM1DRD3KCNH2CHRM2
SCHEMBL15743670 0.87 LPL (0.49) BCHEOPRM1DRD3KCNH2CHRM2
SCHEMBL3375506 0.85 KCNH2 (0.52) BCHEOPRM1DRD3KCNH2CHRM2
SCHEMBL10042891 0.85 KCNH2 (0.52) BCHEOPRM1DRD3KCNH2CHRM2
SCHEMBL13136836 0.85 CALM1 (0.50) GRM2SIGMAR1ALDH1A1
SCHEMBL987390 0.85 KCNH2 (0.52) BCHEOPRM1DRD3KCNH2CHRM2
SCHEMBL1170313 0.85 KCNH2 (0.52) BCHEOPRM1DRD3KCNH2CHRM2
SCHEMBL10358429 0.85 KCNH2 (0.52) BCHEOPRM1DRD3KCNH2CHRM2
SCHEMBL12313748 0.85 KCNH2 (0.52) BCHEOPRM1DRD3KCNH2CHRM2
SCHEMBL13990681 0.85 KCNH2 (0.52) BCHEOPRM1DRD3KCNH2CHRM2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2236488-A1 Materials, methods and uses for photochemical generation of acids and/or radical species The Arizona Board of Regents on behalf of the University of Arizona (US) 2010-10-06 EP disclosed
US-7459106-B2 Materials, methods, and uses for photochemical generation of acids and/or radical species THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2008-12-02 US disclosed
US-20050173683-A1 Materials, methods, and uses for photochemical generation of acids and/or radical species THE ARIZ BD OF REGENTS ON BEHALF OF THE UNIV OF AZ (US) 2005-08-11 US disclosed