SCHEMBL6546887

SCHEMBL6546887

CCCCCc1cccc(-c2ccccc2)c1C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 2/20 0.61
PDCD1 Q15116 1/20 0.61
LIPG Q9Y5X9 1/20 0.46
NR1H2 P55055 1/20 0.45
NR1H3 Q13133 1/20 0.45
PPARA Q07869 2/20 0.43
BID P55957 3/20 0.43
MCL1 Q07820 3/20 0.43
BCL2L1 Q07817 2/20 0.43
BAK1 Q16611 2/20 0.43
KAT8 Q9H7Z6 2/20 0.43
HSD11B1 P28845 1/20 0.43
PPARG P37231 1/20 0.43
EP300 Q09472 1/20 0.43
KAT2A Q92830 1/20 0.43
KAT2B Q92831 1/20 0.43
KAT5 Q92993 1/20 0.43
SAE1 Q9UBE0 1/20 0.43
GCGR P47871 2/20 0.42
TLR8 Q9NR97 1/20 0.42

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
SCHEMBL27988776 0.98 PDCD1 (0.59) CD274PDCD1LIPGNR1H2NR1H3
SCHEMBL8683389 0.95 CD274 (0.62) CD274PDCD1LIPGNR1H2NR1H3
SCHEMBL6546839 0.87 CD274 (0.67) CD274PDCD1PPARADPP4
SCHEMBL28959883 0.87 LIPG (0.48) CD274PDCD1LIPGNR1H2NR1H3
SCHEMBL1024527 0.86 PDCD1 (0.47) CD274PDCD1LIPGNR1H2NR1H3
SCHEMBL19644227 0.86 CD274 (0.66) CD274PDCD1DPP4
SCHEMBL1026184 0.85 PPARA (0.53) CD274PDCD1LIPGNR1H2NR1H3
SCHEMBL1921651 0.85 PPARA (0.49) CD274PDCD1LIPGNR1H2NR1H3
SCHEMBL11663991 0.85 PPARA (0.49) CD274PDCD1LIPGNR1H2NR1H3
SCHEMBL8157125 0.85 PPARA (0.49) CD274PDCD1LIPGNR1H2NR1H3

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