SCHEMBL6546609

SCHEMBL6546609

Cc1cccc(/C=C/C(C)C)c1-c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.38
PDE4B Q07343 2/20 0.38
PDE4C Q08493 2/20 0.38
PDE4D Q08499 2/20 0.38
FABP4 P15090 1/20 0.36
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
CASP1 P29466 1/20 0.35
BRD4 O60885 2/20 0.34
BRD2 P25440 1/20 0.34
PDCD1 Q15116 1/20 0.34
CD274 Q9NZQ7 1/20 0.34
RPA1 P27694 1/20 0.33
MCL1 Q07820 1/20 0.33
FGFR1 P11362 1/20 0.33
FGFR2 P21802 1/20 0.33
FGFR4 P22455 1/20 0.33
FGFR3 P22607 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33

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
SCHEMBL18191762 0.81 ALDH1A1 (0.48) ALDH1A1TSHRPTGS2DHODH
SCHEMBL6546806 0.79 PTGS1 (0.40) PDE4AFABP4ALDH1A1TSHRCASP1
SCHEMBL6546792 0.79 PTGS1 (0.40) PDE4AFABP4ALDH1A1TSHRCASP1
SCHEMBL6547166 0.75 PTGER1 (0.38) FABP4ALDH1A1TSHRCASP1BRD4
SCHEMBL9818110 0.74 CA1 (0.53) FABP4
SCHEMBL9818109 0.74 CA1 (0.53) FABP4
SCHEMBL6441235 0.74 PTGER1 (0.40) FABP4ALDH1A1TSHRCASP1BRD4
SCHEMBL4426820 0.73 TSHR (0.50) FABP4ALDH1A1TSHRBRD4BRD2
SCHEMBL14582403 0.73 ALDH1A1 (0.61) FABP4ALDH1A1TSHRCASP1RPA1
SCHEMBL29023605 0.73 TSHR (0.40) FABP4ALDH1A1TSHRCASP1BRD4

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