SCHEMBL8799892

SCHEMBL8799892

CCCCCCC(C)C(=O)[S]

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.61
ACE2 Q9BYF1 1/20 0.55
GPR84 Q9NQS5 7/20 0.50
FDPS P14324 3/20 0.50
FFAR1 O14842 2/20 0.50
FFAR4 Q5NUL3 1/20 0.50
MAPT P10636 1/20 0.48
LCK P06239 1/20 0.48
PPARD Q03181 1/20 0.48
ZDHHC20 Q5W0Z9 1/20 0.48
ZDHHC2 Q9UIJ5 1/20 0.48
CA2 P00918 1/20 0.47

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
SCHEMBL8800896 1.00 CA1 (0.61) CA1ACE2GPR84FDPSFFAR1
SCHEMBL8798464 1.00 CA1 (0.61) CA1ACE2GPR84FDPSFFAR1
SCHEMBL8805422 0.98 CA1 (0.64) CA1ACE2GPR84FDPSFFAR1
SCHEMBL6722174 0.90
SCHEMBL1321582 0.83 CA1 (0.71) CA1ACE2GPR84FDPSFFAR1
SCHEMBL3211014 0.83 CA1 (0.71) CA1ACE2GPR84FDPSFFAR1
SCHEMBL3231557 0.83 CA1 (0.71) CA1ACE2GPR84FDPSFFAR1
SCHEMBL4350645 0.83 CA1 (0.71) CA1ACE2GPR84FDPSFFAR1
SCHEMBL2710871 0.83 CA1 (0.71) CA1ACE2GPR84FDPSFFAR1
SCHEMBL1922411 0.83 CA1 (0.71) CA1ACE2GPR84FDPSFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5650430-A Radicicol derivatives, their preparation and their anti-tumor activity SANKYO COMPANY, LIMITED (JP) 1997-07-22 US disclosed
EP-0460950-B1 Radicicol derivatives, their preparation and their anti-tumour activity SANKYO CO (JP) 1997-03-05 EP disclosed
US-5597846-A ESTERS OF RADICICOL SANKYO COMPANY, LIMITED (JP) 1997-01-28 US disclosed
WO-1991018905-A1 RADICICOL DERIVATIVES, THEIR PREPARATION AND THEIR ANTI-TUMOR ACTIVITY SANKYO COMPANY LIMITED (JP) 1991-12-12 WO disclosed
EP-0460950-A1 Radicicol derivatives, their preparation and their anti-tumour activity Sankyo Company Limited (JP) 1991-12-11 EP disclosed