SCHEMBL9688090

SCHEMBL9688090

CCC(=O)CC(C)(C)C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.43
FFAR3 O14843 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
HSD17B10 Q99714 1/20 0.30
KDM4E B2RXH2 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
SCHEMBL9737294 0.77 TDP1 (0.45) TDP1FFAR3ALDH1A1KDM4E
SCHEMBL960674 0.76 KDM4E (0.40) TDP1ALDH1A1LMNAHSD17B10KDM4E
SCHEMBL804144 0.74 KDM4E (0.54) TDP1FFAR3ALDH1A1KDM4E
SCHEMBL9842065 0.74 LMNA (0.37) TDP1ALDH1A1LMNAHSD17B10KDM4E
SCHEMBL3465587 0.74 LMNA (0.37) TDP1ALDH1A1LMNAHSD17B10KDM4E
Hydrochloric Acid SCHEMBL3350621 0.74 KDM4E (0.38) TDP1ALDH1A1LMNAHSD17B10KDM4E
SCHEMBL22549656 0.74
SCHEMBL276535 0.73
SCHEMBL270702 0.73
SCHEMBL5069470 0.72 KDM4E (0.31) TDP1ALDH1A1LMNAHSD17B10KDM4E

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
EP-0464588-A1 Use of vacuum for improved density in laser-induced thermal dye transfer EASTMAN KODAK COMPANY (US) 1992-01-08 EP disclosed
US-5017547-A Spacings EASTMAN KODAK COMPANY (US) 1991-05-21 US disclosed