SCHEMBL2231085

SCHEMBL2231085

O=C(O)OC(CO)CO.O=C(O)OCCOC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 4/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
MGLL Q99685 1/20 0.33
PRKCE Q02156 1/20 0.31
PRKCQ Q04759 1/20 0.31
PRKCD Q05655 1/20 0.31

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
SCHEMBL44488 0.87
SCHEMBL6009741 0.85 MAPT (0.40) PRKCAMAPTMAPK1MGLLPRKCE
SCHEMBL5030994 0.85 MAPT (0.40) PRKCAMAPTMAPK1MGLLPRKCE
Bicarbonate SCHEMBL3335342 0.85 MAPT (0.40) PRKCAMAPTMAPK1MGLLPRKCE
SCHEMBL30585906 0.81 PRKCA (0.48) PRKCAPRKCEPRKCQPRKCD
SCHEMBL2266760 0.81 PRKCA (0.48) PRKCAPRKCEPRKCQPRKCD
SCHEMBL3544475 0.81 ALDH1A1 (0.32) PRKCA
Alcohol SCHEMBL20504372 0.80 MAPT (0.47) PRKCAMAPTMAPK1PRKCEPRKCQ
Succinic Acid SCHEMBL7186929 0.78 LMNA (0.45) PRKCAMAPTMAPK1MGLL
SCHEMBL2487067 0.78

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
US-7977402-B2 Photocation polymerization initiator, a free-radical photoinitiator; an acrylate ester of a carboxylic acid ester; and material containing a radiation curable functional group; imppulse printheads COLLINS INK CORPORATION (US) 2011-07-12 US disclosed
US-20080090930-A1 Photocation polymerization initiator, a free-radical photoinitiator; an acrylate ester of a carboxylic acid ester; and material containing a radiation curable functional group; imppulse printheads HEXION SPECIALTY CHEMICALS, INC. 2008-04-17 US disclosed