SCHEMBL23789983

SCHEMBL23789983

C=CC(=O)NCCCOCCOC(=O)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.47
ZDHHC2 Q9UIJ5 1/20 0.47
TSHR P16473 5/20 0.42
ALDH1A1 P00352 3/20 0.42
TP53 P04637 2/20 0.42
HIF1A Q16665 2/20 0.42
HSD17B10 Q99714 2/20 0.42
MAPT P10636 1/20 0.40
TGM2 P21980 5/20 0.39
GAA P10253 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPK1 P28482 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ACHE P22303 1/20 0.35

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
SCHEMBL26478818 0.90 ZDHHC20 (0.53) ZDHHC20ZDHHC2TSHRALDH1A1TGM2
SCHEMBL18977182 0.88 ZDHHC20 (0.47) ZDHHC20ZDHHC2TSHRALDH1A1TP53
SCHEMBL9889645 0.87 ZDHHC20 (0.55) ZDHHC20ZDHHC2TSHRALDH1A1TP53
SCHEMBL24715024 0.87 ZDHHC20 (0.55) ZDHHC20ZDHHC2TSHRALDH1A1TP53
SCHEMBL5530407 0.87 ZDHHC20 (0.55) ZDHHC20ZDHHC2TSHRALDH1A1TP53
SCHEMBL2608177 0.85 ZDHHC20 (0.56) ZDHHC20ZDHHC2TSHRALDH1A1TGM2
SCHEMBL12328963 0.85 ZDHHC20 (0.57) ZDHHC20ZDHHC2TSHRALDH1A1TP53
SCHEMBL2608197 0.84 ZDHHC20 (0.59) ZDHHC20ZDHHC2TSHRALDH1A1TGM2
SCHEMBL2608182 0.83 ZDHHC20 (0.47) ZDHHC20ZDHHC2TSHRALDH1A1TGM2
SCHEMBL24715512 0.83 ZDHHC20 (0.56) ZDHHC20ZDHHC2TSHRALDH1A1TP53

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-3530257-B1 SELF-ADHESIVE DENTAL COMPOSITE RESIN KURARAY NORITAKE DENTAL INC (JP) 2021-09-08 EP disclosed