SCHEMBL8772487

SCHEMBL8772487

CCCCCCCCCCCCCCCCCCCCC(O)C(=O)OC(CO)CO

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.56
MAPK1 P28482 1/20 0.56
GPR84 Q9NQS5 3/20 0.53
FFAR1 O14842 1/20 0.53
PRKCA P17252 3/20 0.49
PRKCE Q02156 2/20 0.49
PRKCQ Q04759 2/20 0.49
PRKCD Q05655 2/20 0.49
LMNA P02545 2/20 0.44
KDM4E B2RXH2 1/20 0.44
DUSP3 P51452 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ZDHHC7 Q9NXF8 1/20 0.43

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
SCHEMBL228284 1.00 MAPT (0.56) MAPTMAPK1GPR84FFAR1PRKCA
SCHEMBL5199055 1.00 MAPT (0.56) MAPTMAPK1GPR84FFAR1PRKCA
SCHEMBL10712293 1.00 MAPT (0.56) MAPTMAPK1GPR84FFAR1PRKCA
Ethylene Glycol SCHEMBL27039268 0.97 MAPT (0.53) MAPTMAPK1GPR84FFAR1PRKCA
Propene SCHEMBL4995113 0.92 MAPT (0.49) MAPTMAPK1GPR84FFAR1PRKCA
SCHEMBL10715157 0.91 FAAH (0.56) MAPTPRKCAPRKCEPRKCQPRKCD
SCHEMBL3312860 0.89 GPR84 (0.57) MAPTMAPK1GPR84FFAR1LMNA
SCHEMBL29697233 0.89 GPR84 (0.57) MAPTMAPK1GPR84FFAR1LMNA
SCHEMBL30778412 0.89 GPR84 (0.57) MAPTMAPK1GPR84FFAR1LMNA
SCHEMBL223182 0.89 GPR84 (0.57) MAPTMAPK1GPR84FFAR1LMNA

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
EP-0516351-B1 Flame-retardant polybutylene terephthalate resin composition POLYPLASTICS CO (JP) 1997-10-15 EP disclosed
US-5258434-A Halogenated phenoxy compound, antimony pentaoxide, alkali metal oxide, fatty acid ester, and filler; electronics POLYPLASTICS CO., LTD. (JP) 1993-11-02 US disclosed
EP-0516351-A2 Flame-retardant polybutylene terephthalate resin composition POLYPLASTICS CO. LTD. (JP) 1992-12-02 EP disclosed