SCHEMBL6547357

SCHEMBL6547357

CCC(c1ccc(C)cc1)C(C)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HKDC1 Q2TB90 1/20 0.44
TAAR1 Q96RJ0 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 1/20 0.41
LMNA P02545 4/20 0.41
ESR1 P03372 2/20 0.41
CYP1A2 P05177 1/20 0.41
PGR P06401 1/20 0.41
CHRM2 P08172 1/20 0.41
CYP3A4 P08684 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
AR P10275 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
CHRM1 P11229 1/20 0.41
CYP2C9 P11712 1/20 0.41
ALOX15 P16050 1/20 0.41
DRD1 P21728 1/20 0.41
TBXA2R P21731 1/20 0.41
PTGS1 P23219 1/20 0.41

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
SCHEMBL6546892 1.00 HKDC1 (0.44) HKDC1TAAR1SMN1; SMN2ALDH1A1LMNA
SCHEMBL6547351 0.90 HKDC1 (0.52) HKDC1TAAR1LMNAESR1CYP1A2
SCHEMBL18884386 0.81 ACP3 (0.47) HKDC1TAAR1LMNASLC6A2OPRM1
SCHEMBL6548164 0.81 LMNA (0.50) TAAR1SMN1; SMN2LMNAOPRM1TDP1
SCHEMBL17278368 0.79 TYR (0.48) HKDC1TAAR1ALDH1A1LMNAESR1
SCHEMBL23188100 0.77 ESR1 (0.48) HKDC1TAAR1SMN1; SMN2ALDH1A1LMNA
SCHEMBL2356591 0.77 HTR2A (0.48) TAAR1SMN1; SMN2ALDH1A1LMNATDP1
SCHEMBL25079595 0.77 ESR1 (0.60) HKDC1ALDH1A1LMNAESR1CYP1A2
SCHEMBL4071581 0.76 HKDC1 (0.65) HKDC1TAAR1LMNAESR1CYP1A2
SCHEMBL1130427 0.75 LMNA (0.43) TAAR1SMN1; SMN2LMNAMAPTOPRM1

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