SCHEMBL28294802

SCHEMBL28294802

CCCCCC(OCC)OC(=O)OOC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.38
GPR84 Q9NQS5 7/20 0.37
FFAR1 O14842 2/20 0.37
MAPT P10636 1/20 0.36
LCK P06239 1/20 0.36
PPARD Q03181 1/20 0.36
ZDHHC20 Q5W0Z9 1/20 0.36
ZDHHC2 Q9UIJ5 1/20 0.36
FFAR4 Q5NUL3 1/20 0.34
ACE2 Q9BYF1 1/20 0.34
ZDHHC7 Q9NXF8 1/20 0.33
CA1 P00915 1/20 0.33
FAAH O00519 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
SCHEMBL28389236 0.93 SMPD1 (0.42) SMPD1GPR84FFAR1MAPTLCK
Bicarbonate SCHEMBL28895868 0.79 SMPD1 (0.47) SMPD1GPR84FFAR1MAPTLCK
SCHEMBL11530999 0.78 SMPD1 (0.43) SMPD1GPR84FFAR1MAPTLCK
SCHEMBL28417851 0.77 FAAH (0.51) GPR84FFAR1MAPTLCKPPARD
SCHEMBL3475994 0.77 PRKCA (0.40) GPR84FFAR1MAPTLCKPPARD
SCHEMBL3438702 0.76 NAAA (0.33) SMPD1
SCHEMBL19547888 0.76 LMNA (0.52) SMPD1MAPTFAAH
SCHEMBL9420736 0.75 SMPD1 (0.41) SMPD1GPR84FFAR1MAPTLCK
Bicarbonate SCHEMBL28294803 0.74 SMPD1 (0.43) SMPD1GPR84FFAR1MAPTLCK
SCHEMBL9420733 0.73 SMPD1 (0.43) SMPD1GPR84FFAR1MAPTLCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114656582-A Toughened high-molecular polyvinyl chloride resin and preparation method thereof 天伟化工有限公司 2022-06-24 CN disclosed
CN-109689778-A Fire retardant resin composition and resin coated copper foil 拓自达电线株式会社 2019-04-26 CN disclosed