SCHEMBL18053151

SCHEMBL18053151

COCCN(CCO)CC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
ALOX15 P16050 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TRPA1 O75762 1/20 0.33
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CYP2D6 P10635 1/20 0.32

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
SCHEMBL12735158 0.92 TRPA1 (0.39) KDM4EALOX15TRPA1BLMPMP22
SCHEMBL19546089 0.88 BLM (0.41) KDM4EMAPTALOX15SMN1; SMN2TRPA1
SCHEMBL12779671 0.85 ALOX15 (0.50) KDM4EMAPTALOX15SMN1; SMN2TRPA1
SCHEMBL21427999 0.84 CYP2D6 (0.37) SMN1; SMN2TRPA1BLMPMP22HSD17B10
SCHEMBL14012821 0.84 BLM (0.50) KDM4EMAPTALOX15SMN1; SMN2BLM
SCHEMBL22821372 0.81 ALDH1A1 (0.41) KDM4EMAPTALOX15SMN1; SMN2TRPA1
SCHEMBL19545889 0.81 CYP2D6 (0.41) CYP2D6
SCHEMBL8571 0.80 MAPT (0.36) KDM4EMAPTALOX15SMN1; SMN2HSD17B10
SCHEMBL5345639 0.80 MAPT (0.36) KDM4EMAPTALOX15SMN1; SMN2HSD17B10
SCHEMBL18412665 0.80 BLM (0.55) KDM4EALOX15SMN1; SMN2BLMPMP22

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
US-20160251470-A1 ZWITTERIONIC POLYSACCHARIDE POLYMERS HAVING ANTIFOULING, ANTIMICROBIAL AND OPTICAL TRANSPARENCY PROPERTIES NATIONAL SCIENCE FOUNDATION 2016-09-01 US disclosed