SCHEMBL4425044

SCHEMBL4425044

CC(C)(C=O)COC(=O)CCCCCCCCC(=O)OCC(C)(C)C=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.44
TSHR P16473 2/20 0.42
PAM P19021 2/20 0.40
MAPT P10636 1/20 0.38
ALDH1A1 P00352 3/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 3/20 0.37
DNM1 Q05193 1/20 0.37
KDM4E B2RXH2 1/20 0.36
DUSP3 P51452 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP1A2 P05177 1/20 0.35
GAA P10253 1/20 0.35
PRKCA P17252 1/20 0.34
PRKCE Q02156 1/20 0.34
PRKCQ Q04759 1/20 0.34

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
SCHEMBL10572750 1.00 DGKA (0.44) DGKATSHRPAMMAPTALDH1A1
SCHEMBL197167 0.93 DGKA (0.56) DGKATSHRPAMMAPTALDH1A1
SCHEMBL340251 0.93 DGKA (0.56) DGKATSHRPAMMAPTALDH1A1
SCHEMBL342390 0.93 DGKA (0.56) DGKATSHRPAMMAPTALDH1A1
SCHEMBL1933672 0.93 DGKA (0.56) DGKATSHRPAMMAPTALDH1A1
SCHEMBL9935881 0.93 DGKA (0.56) DGKATSHRPAMMAPTALDH1A1
SCHEMBL341269 0.93 DGKA (0.56) DGKATSHRPAMMAPTALDH1A1
SCHEMBL9935331 0.93 DGKA (0.56) DGKATSHRPAMMAPTALDH1A1
SCHEMBL3110064 0.93 DGKA (0.56) DGKATSHRPAMMAPTALDH1A1
SCHEMBL31462283 0.91 CYP1A2 (0.46) DGKATSHRPAMMAPTALDH1A1

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-7625993-B2 Polyaldimines SIKA TECHNOLOGY AG (CH) 2009-12-01 US disclosed
US-20060149025-A1 Polyaldimines SIKA TECHNOLOGY AG (CH) 2006-07-06 US disclosed