SCHEMBL6548137

SCHEMBL6548137

CCc1ccc(CCCCc2ccccc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.70
MAOB P27338 2/20 0.60
MAOA P21397 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
HTR2A P28223 1/20 0.54
SIGMAR1 Q99720 5/20 0.54
CHRM2 P08172 1/20 0.54
HTR1A P08908 1/20 0.54
ADRA2A P08913 1/20 0.54
CHRM1 P11229 1/20 0.54
DRD1 P21728 1/20 0.54
SLC6A2 P23975 1/20 0.54
SLC6A4 P31645 1/20 0.54
ADRA1A P35348 1/20 0.54
OPRM1 P35372 1/20 0.54
DRD3 P35462 1/20 0.54
SLC6A3 Q01959 1/20 0.54
KCNH2 Q12809 1/20 0.54
TAAR1 Q96RJ0 1/20 0.52
IGF1R P08069 1/20 0.52

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
SCHEMBL3025006 0.95 TP53 (0.70) TP53MAOBMAOAL3MBTL1HTR2A
SCHEMBL633290 0.90 TP53 (0.78) TP53MAOBMAOAHTR2ACHRM2
SCHEMBL10575050 0.89 TAAR1 (0.62) TP53MAOBHTR2ACHRM2ADRA2A
Butylbenzyl SCHEMBL7170859 0.88 TP53 (0.67) TP53MAOAL3MBTL1SIGMAR1CHRM2
SCHEMBL10571221 0.87 TAAR1 (0.59) TP53HTR2ACHRM2ADRA2ACHRM1
Ethylbenzene SCHEMBL8093416 0.87 TP53 (0.82) TP53MAOBMAOAHTR2ACHRM2
Ethylbenzene SCHEMBL27405402 0.87 TP53 (0.93) TP53TAAR1
Ethylbenzene SCHEMBL1330604 0.84
Ethylbenzene SCHEMBL7458207 0.84 TP53 (1.00) TP53TAAR1
Ethylbenzene SCHEMBL11223212 0.84 TP53 (1.00) TP53TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0717098-B1 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON MITSUBISHI OIL CORP (JP) 2004-01-21 EP disclosed
US-5817251-A AROMATIC HYDROCARBON LUBRICANT NIPPON OIL CO., LTD. (JP) 1998-10-06 US disclosed
US-5711895-A Fluid composition for use in a refrigerating machine in which the refrigerating machine oil is at least one hydrocarbon compound of a formula consisting of two phenyl groups joined through an alkylene or alkenylene group NIPPON OIL CO., LTD. (JP) 1998-01-27 US disclosed
EP-0717098-A2 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON OIL CO. LTD. (JP) 1996-06-19 EP disclosed