SCHEMBL6546083

SCHEMBL6546083

CCCc1ccc(C(C)c2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.50
SIGMAR1 Q99720 2/20 0.47
OPRM1 P35372 2/20 0.44
OPRD1 P41143 1/20 0.44
OPRK1 P41145 1/20 0.44
OPRL1 P41146 1/20 0.44
LPL P06858 1/20 0.41
LIPG Q9Y5X9 1/20 0.41
ACACB O00763 1/20 0.41
GRM2 Q14416 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
FFAR1 O14842 1/20 0.39
TAAR1 Q96RJ0 2/20 0.39
LMNA P02545 1/20 0.39
CHRM2 P08172 1/20 0.38
HTR1A P08908 1/20 0.38

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
SCHEMBL9621041 0.91 LPL (0.46) HTR2ASIGMAR1LPLLIPGACACB
SCHEMBL6547609 0.88 HTR2A (0.60) HTR2ASIGMAR1OPRM1OPRL1ALDH1A1
SCHEMBL6615896 0.88 HTR2A (0.45) HTR2ASIGMAR1OPRM1OPRD1OPRK1
SCHEMBL11767109 0.85 HTR2A (0.71) HTR2ALPLLIPGKDM4EALDH1A1
SCHEMBL5200395 0.85 HTR2A (0.71) HTR2ALPLLIPGKDM4EALDH1A1
SCHEMBL6547906 0.83 HTR2A (0.54) HTR2ASIGMAR1OPRM1OPRD1OPRK1
SCHEMBL6547850 0.83 CYP1A2 (0.45) SIGMAR1LPLLIPGACACBTAAR1
SCHEMBL444227 0.83 TP53 (0.56) HTR2AOPRM1OPRD1OPRK1OPRL1
SCHEMBL28059422 0.82 MAOA (0.46) SIGMAR1ALDH1A1HPGDTAAR1SLC6A2
SCHEMBL9762253 0.82 TAAR1 (0.58) HTR2ATAAR1

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