SCHEMBL8679934

SCHEMBL8679934

Cc1c(CC(C)C)cccc1-c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 12/20 0.65
PDCD1 Q15116 2/20 0.65
GABRA1 P14867 1/20 0.47
GABRB2 P47870 1/20 0.47
KMT2A Q03164 1/20 0.44
DPP4 P27487 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
SCHEMBL8679274 0.85 CD274 (0.46) CD274PDCD1GABRA1GABRB2KMT2A
SCHEMBL4630258 0.84 KMT2A (0.60) CD274PDCD1GABRA1GABRB2KMT2A
SCHEMBL2416595 0.81 GABRA1 (0.47) CD274PDCD1GABRA1GABRB2KMT2A
SCHEMBL28428374 0.81 KMT2A (0.52) CD274PDCD1GABRA1GABRB2KMT2A
SCHEMBL4151221 0.81 CD274 (0.69) CD274PDCD1DPP4
SCHEMBL1241629 0.80 KMT2A (0.47) CD274PDCD1GABRA1GABRB2KMT2A
SCHEMBL22781148 0.80 GABRA1 (0.62) CD274PDCD1GABRA1GABRB2
SCHEMBL358303 0.79 CD274 (1.00) CD274PDCD1KMT2ADPP4
SCHEMBL29558512 0.79 CD274 (1.00) CD274PDCD1KMT2ADPP4
SCHEMBL607544 0.79 CD274 (0.71) CD274PDCD1GABRA1GABRB2KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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