SCHEMBL14035387

SCHEMBL14035387

C=CCC(COC(C)(C)C(C)(C)C(=O)C(OC(C)(C)C)c1ccccc1)C(=O)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 2/20 0.33
USP2 O75604 4/20 0.33
ATM Q13315 2/20 0.32
GAA P10253 1/20 0.32
CYP3A4 P08684 1/20 0.31
HIF1A Q16665 1/20 0.31
PPARG P37231 1/20 0.30
PPARA Q07869 1/20 0.30

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
SCHEMBL14035474 0.90 CYP2C19 (0.35) CYP2C19L3MBTL1SMN1; SMN2MAPTUSP2
SCHEMBL13768105 0.84 CYP2C19 (0.39) CYP2C19L3MBTL1SMN1; SMN2MAPTUSP2
SCHEMBL14035566 0.78
SCHEMBL13844189 0.76 CYP2C19 (0.34) CYP2C19L3MBTL1SMN1; SMN2MAPT
SCHEMBL13513681 0.75 PRKCA (0.33) SMN1; SMN2
SCHEMBL14035443 0.73 PPARG (0.36) L3MBTL1MAPTUSP2ATMPPARG
SCHEMBL13997830 0.72 MAPK1 (0.38) CYP2C19MAPTATMGAACYP3A4
SCHEMBL14035439 0.68
SCHEMBL13844146 0.67 PPARG (0.35) MAPTUSP2PPARGPPARA
SCHEMBL13844227 0.66 ALDH1A1 (0.36) L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1774410-B1 CHARGE CONTROL AGENT, TONER, IMAGE FORMING METHOD, AND IMAGE FORMING APPARATUS CANON KK (JP) 2008-11-19 EP disclosed