SCHEMBL8778088

SCHEMBL8778088

CCCC(=O)N(OC(C)=O)C(=O)CCC

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.40
LMNA P02545 2/20 0.40
HSD17B10 Q99714 1/20 0.40
CES1 P23141 2/20 0.38
CES2 O00748 1/20 0.38
HDAC1 Q13547 5/20 0.36
HDAC2 Q92769 5/20 0.36
HDAC3 O15379 4/20 0.36
HDAC8 Q9BY41 4/20 0.36
FFAR3 O14843 3/20 0.36
TSHR P16473 2/20 0.35
TP53 P04637 1/20 0.34
HDAC6 Q9UBN7 2/20 0.32
CTSD P07339 1/20 0.31
HPGD P15428 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
SCHEMBL8778080 0.91 ALDH1A1 (0.37) ALDH1A1LMNAHSD17B10CES1CES2
SCHEMBL4760570 0.81 ALDH1A1 (0.50) ALDH1A1LMNACES1CES2HDAC1
SCHEMBL13855861 0.79 ALDH1A1 (0.39) ALDH1A1LMNAHSD17B10CES1CES2
SCHEMBL13636953 0.74 ALDH1A1 (0.34) ALDH1A1LMNAHSD17B10CES1CES2
SCHEMBL3840440 0.73 HTT (0.35) ALDH1A1LMNAHSD17B10CES1CES2
SCHEMBL8269048 0.71 ALDH1A1 (0.40) ALDH1A1LMNAHSD17B10TSHR
SCHEMBL14819938 0.68 LMNA (0.42) ALDH1A1LMNACES1CES2HDAC1
SCHEMBL9710422 0.68 CES2 (0.50) ALDH1A1LMNACES1CES2HDAC1
SCHEMBL133026 0.68 NQO1 (0.41) ALDH1A1LMNAHSD17B10TSHR
SCHEMBL8778249 0.67 ALDH1A1 (0.50) ALDH1A1LMNACES1CES2HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0576622-B1 LITHOGRAPHIC PRINTING PLATES EASTMAN KODAK CO (US) 1997-11-05 EP disclosed
EP-0576622-A1 LITHOGRAPHIC PRINTING PLATES EASTMAN KODAK COMPANY (US) 1994-01-05 EP disclosed
WO-1992017821-A1 LITHOGRAPHIC PRINTING PLATES EASTMAN KODAK COMPANY (US) 1992-10-15 WO disclosed
US-5141839-A LITHOGRAPHIC PRINTING PLATES HAVING A RADIATION-SENSITIVE LAYER COMPRISING A PHOTOCROSSLINKABLE POLYMER, A LEUCO DYE, A PHOTOOXIDANT AND A HETEROAROMATIC AMINE N-OXIDE EASTMAN KODAK COMPANY (US) 1992-08-25 US disclosed
US-5141842-A Negative working lithography printing plates EASTMAN KODAK COMPANY (US) 1992-08-25 US disclosed