SCHEMBL8850000

SCHEMBL8850000

CC(=CCCCCCCCCCCCCN(C)C)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
TSHR P16473 1/20 0.42
EP300 Q09472 1/20 0.41
KDM4A O75164 12/20 0.40
KDM4C Q9H3R0 12/20 0.40
KDM5A P29375 1/20 0.40
KDM7A Q6ZMT4 1/20 0.40
PHF8 Q9UPP1 1/20 0.40
KDM2A Q9Y2K7 1/20 0.40
TBXAS1 P24557 1/20 0.38
KDM4E B2RXH2 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL8850043 1.00 ALDH1A1 (0.42) ALDH1A1TSHREP300KDM4AKDM4C
SCHEMBL4352201 1.00 ALDH1A1 (0.42) ALDH1A1TSHREP300KDM4AKDM4C
SCHEMBL8849865 1.00 ALDH1A1 (0.42) ALDH1A1TSHREP300KDM4AKDM4C
SCHEMBL4352572 1.00 ALDH1A1 (0.42) ALDH1A1TSHREP300KDM4AKDM4C
SCHEMBL329006 0.98 ALDH1A1 (0.39) ALDH1A1TSHREP300KDM4AKDM4C
SCHEMBL6065434 0.98 ALDH1A1 (0.39) ALDH1A1TSHREP300KDM4AKDM4C
SCHEMBL23342 0.92 USP2 (0.38) ALDH1A1TSHREP300KDM4AKDM4C
SCHEMBL637089 0.92 USP2 (0.38) ALDH1A1TSHREP300KDM4AKDM4C
Ammonia Solution, Strong SCHEMBL29268390 0.90 USP2 (0.37) ALDH1A1TSHREP300KDM4AKDM4C
SCHEMBL4859249 0.89 USP2 (0.36) ALDH1A1EP300KDM4AKDM4CKDM5A

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-0526800-B1 Polymers from N-containing monomers polymerised in the presence of monosaccharids, oligosaccharids or polysaccharids and derivatives BASF AG (DE) 1997-01-08 EP disclosed
EP-0526800-A1 Polymers from N-containing monomers polymerised in the presence of monosaccharids, oligosaccharids or polysaccharids and derivatives BASF Aktiengesellschaft (DE) 1993-02-10 EP disclosed