SCHEMBL6546261

SCHEMBL6546261

CCc1ccc(C=Cc2ccc(CC)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.63
PTGS1 P23219 1/20 0.63
PTGS2 P35354 1/20 0.63
TUBB1 Q9H4B7 1/20 0.59
TP53 P04637 1/20 0.48
DHFR P00374 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
LMNA P02545 2/20 0.45
MAPT P10636 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 1/20 0.45
CYP2C9 P11712 1/20 0.45
MAOB P27338 2/20 0.44
MAOA P21397 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL9026432 1.00 ALOX5 (0.63) ALOX5PTGS1PTGS2TUBB1TP53
SCHEMBL9026437 1.00 ALOX5 (0.63) ALOX5PTGS1PTGS2TUBB1TP53
SCHEMBL16853122 1.00 ALOX5 (0.63) ALOX5PTGS1PTGS2TUBB1TP53
SCHEMBL6547298 0.90 TP53 (0.59) ALOX5PTGS1PTGS2TUBB1TP53
SCHEMBL29086916 0.90 PTGS1 (0.60) ALOX5PTGS1PTGS2TUBB1DHFR
SCHEMBL16105660 0.90 TP53 (0.59) ALOX5PTGS1PTGS2TUBB1TP53
SCHEMBL6546965 0.90 PTGS1 (0.60) ALOX5PTGS1PTGS2TUBB1DHFR
SCHEMBL16105872 0.90 TP53 (0.59) ALOX5PTGS1PTGS2TUBB1TP53
SCHEMBL28779438 0.90 PTGS1 (0.60) ALOX5PTGS1PTGS2TUBB1DHFR
SCHEMBL24484876 0.88 NFE2L2 (0.58) ALOX5PTGS1PTGS2TUBB1LMNA

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