SCHEMBL8819219

SCHEMBL8819219

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

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
TSHR P16473 1/20 0.36
FGFR4 P22455 1/20 0.36

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
SCHEMBL7138072 0.77 ALDH1A1 (0.36) ALDH1A1TSHRFGFR4
SCHEMBL29616204 0.76 ALDH1A1 (0.31) ALDH1A1TSHRFGFR4
SCHEMBL20126024 0.75 DGAT1 (0.33)
SCHEMBL20210993 0.75 ALDH1A1 (0.35) ALDH1A1
SCHEMBL4812023 0.75 ALDH1A1 (0.35) ALDH1A1
Bicarbonate SCHEMBL8516514 0.73 LMNA (0.35) ALDH1A1
SCHEMBL829991 0.72 ALDH1A1 (0.36) ALDH1A1TSHRFGFR4
SCHEMBL21239140 0.71 THRA (0.32) ALDH1A1TSHR
SCHEMBL20126034 0.71 PKM (0.37) ALDH1A1TSHR
SCHEMBL20126035 0.71 TSHR (0.31) TSHR

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
WO-1997040078-A1 THERMOREVERSIBLE HYDROGELS COMPRISING NON-CROSSLINKED COPOLYMERS AND THEIR USE IN ELECTROPHORESIS SOANE BIOSCIENCES (US) 1997-10-30 WO disclosed