SCHEMBL6547413

SCHEMBL6547413

CCc1cccc(C(C)c2ccccc2)c1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.45
TYR P14679 1/20 0.40
GABRA1 P14867 3/20 0.38
GABRB2 P47870 2/20 0.38
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
OPRL1 P41146 1/20 0.38
SLC6A4 P31645 2/20 0.36
SLC6A2 P23975 1/20 0.36
TAAR1 Q96RJ0 2/20 0.35
LMNA P02545 2/20 0.35
ACP3 P15309 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NLRP3 Q96P20 1/20 0.35
GAA P10253 1/20 0.35
TSHR P16473 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MCOLN3 Q8TDD5 1/20 0.35

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
SCHEMBL3074943 0.86 HTT (0.45) HTTTYRGABRA1GABRB2OPRM1
SCHEMBL28674805 0.86 HTT (0.45) HTTTYRGABRA1GABRB2OPRM1
SCHEMBL29486474 0.86 HTT (0.45) HTTTYRGABRA1GABRB2OPRM1
SCHEMBL9621059 0.86 GABRA1 (0.44) HTTGABRA1GABRB2SLC6A2LMNA
SCHEMBL6547970 0.85 HTT (0.42) HTTGABRA1GABRB2OPRM1OPRD1
SCHEMBL6547447 0.84 HTT (0.48) HTTTYRGABRA1GABRB2OPRM1
SCHEMBL4657529 0.84 HTT (0.44) HTTTYRGABRA1GABRB2OPRM1
SCHEMBL10601615 0.83 HTT (0.43) HTTTYRGABRA1GABRB2OPRM1
SCHEMBL10833197 0.82 GABRA1 (0.53) HTTTYRGABRA1GABRB2OPRM1
SCHEMBL4658390 0.82 CNR2 (0.43) TYRSLC6A4SLC6A2TAAR1L3MBTL1

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 5 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
US-4347169-A MIXTURE OF A DIARYLALKANE AND AN ARYLINDANE AND-OR 1,3-DIARYLBUTENE NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1982-08-31 US disclosed