SCHEMBL7308498

SCHEMBL7308498

Fc1ccc(C=CCN2CCC(=C3c4ccccc4C=Cc4ccccc43)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SETD7 Q8WTS6 3/20 0.54
CYP2D6 P10635 4/20 0.48
OPRM1 P35372 4/20 0.48
CYP1A2 P05177 3/20 0.48
ADRA2A P08913 3/20 0.48
ADRA2C P18825 3/20 0.48
SLC6A4 P31645 3/20 0.48
CHRM2 P08172 2/20 0.48
CHRM4 P08173 2/20 0.48
HTR1A P08908 2/20 0.48
CHRM5 P08912 2/20 0.48
CHRM1 P11229 2/20 0.48
DRD2 P14416 2/20 0.48
ADRA2B P18089 2/20 0.48
CHRM3 P20309 2/20 0.48
DRD1 P21728 2/20 0.48
SLC6A2 P23975 2/20 0.48
ADRA1D P25100 2/20 0.48
HTR2A P28223 2/20 0.48
HTR2C P28335 2/20 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
SCHEMBL7308496 1.00 SETD7 (0.54) SETD7CYP2D6OPRM1CYP1A2ADRA2A
SCHEMBL7306252 0.90 SETD7 (0.59) SETD7CYP2D6OPRM1CYP1A2ADRA2A
SCHEMBL7306260 0.90 SETD7 (0.59) SETD7CYP2D6OPRM1CYP1A2ADRA2A
Hydrochloric Acid SCHEMBL7295701 0.89 SETD7 (0.58) SETD7CYP2D6OPRM1CYP1A2ADRA2A
Hydrochloric Acid SCHEMBL7295705 0.89 SETD7 (0.58) SETD7CYP2D6OPRM1CYP1A2ADRA2A
SCHEMBL7436166 0.88 SETD7 (0.54) SETD7CYP2D6OPRM1CYP1A2ADRA2A
SCHEMBL7296028 0.88 SETD7 (0.54) SETD7CYP2D6OPRM1CYP1A2ADRA2A
SCHEMBL7433819 0.88 SETD7 (0.54) SETD7CYP2D6OPRM1CYP1A2ADRA2A
SCHEMBL7296032 0.88 SETD7 (0.54) SETD7CYP2D6OPRM1CYP1A2ADRA2A
SCHEMBL7308734 0.87 SETD7 (0.51) SETD7CYP2D6OPRM1CYP1A2ADRA2A

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-0479601-B1 Piperidine derivatives and their use as antiarrhythmic agents AJINOMOTO KK (JP) 1999-12-15 EP claimed
US-5229400-A Cardiovascular disorders AJINOMOTO CO., INC. (JP) 1993-07-20 US disclosed
EP-0479601-A2 Piperidine derivatives and their use as antiarrhythmic agents Ajinomoto Co., Inc. (JP) 1992-04-08 EP disclosed