SCHEMBL11208747

SCHEMBL11208747

Cc1ccccc1-c1ccccc1C(C)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.42
ACP3 P15309 1/20 0.41
CYP2D6 P10635 2/20 0.39
SLC22A2 O15244 1/20 0.39
SLC22A1 O15245 1/20 0.39
GRIN2D O15399 1/20 0.39
GRIN3B O60391 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM5 P08912 1/20 0.39
ADRA2A P08913 1/20 0.39
CHRM1 P11229 1/20 0.39
ADRA2B P18089 1/20 0.39
CHRM3 P20309 1/20 0.39
DRD1 P21728 1/20 0.39
SLC6A2 P23975 1/20 0.39
HRH2 P25021 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
SLC6A4 P31645 1/20 0.39

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
SCHEMBL11204136 0.87 TYR (0.39) TYRACP3CYP2D6SLC22A2SLC22A1
SCHEMBL11204879 0.83 ESR1 (0.45) ACP3CYP2D6SLC22A2SLC22A1GRIN2D
SCHEMBL28666265 0.83 ACP3 (0.50) TYRACP3CYP2D6SLC22A2SLC22A1
SCHEMBL710709 0.83 ACP3 (0.50) TYRACP3CYP2D6SLC22A2SLC22A1
SCHEMBL29638766 0.83 ACP3 (0.50) TYRACP3CYP2D6SLC22A2SLC22A1
SCHEMBL7084449 0.80 PTGS2 (0.44) DRD1
SCHEMBL8679281 0.79 TYR (0.44) TYRCHRM2CHRM4CHRM5CHRM1
SCHEMBL29358402 0.79 ADRA2A (0.47) TYRACP3CYP2D6SLC22A2SLC22A1
SCHEMBL10599645 0.79 ACP3 (0.47) TYRACP3CYP2D6SLC22A2SLC22A1
SCHEMBL115911 0.79 ADRA2A (0.47) TYRACP3CYP2D6SLC22A2SLC22A1

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-4371726-A Composition suitable for mechanical power transmission and process for operating traction drives NIPPON STEEL CHEMICAL CO., LTD. (JP) 1983-02-01 US disclosed