SCHEMBL17010197

SCHEMBL17010197

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

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.39
TET2 Q6N021 1/20 0.37
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
OR51E2 Q9H255 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
SCHEMBL27806694 0.85 TDP1 (0.39) TDP1TET2KDM4EALDH1A1LMNA
SCHEMBL3232065 0.82 TDP1 (0.41) TDP1TET2KDM4EALDH1A1LMNA
SCHEMBL1135153 0.76 TDP1 (0.36) TDP1TET2
SCHEMBL17010095 0.76 TDP1 (0.36) TDP1TET2
SCHEMBL17183706 0.76 TDP1 (0.36) TDP1TET2KDM4E
SCHEMBL22490940 0.76 TDP1 (0.36) TDP1TET2
Tert-Butylamine SCHEMBL29106638 0.75 TDP1 (0.39) TDP1TET2ALDH1A1LMNAOR51E2
SCHEMBL4853960 0.75 TDP1 (0.35) TDP1TET2KDM4E
SCHEMBL5668482 0.74 TDP1 (0.36) TDP1TET2ALDH1A1LMNAOR51E2
SCHEMBL3112492 0.73 TDP1 (0.33) TDP1TET2

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-3105286-A1 PROCESS FOR CURING (METH)ACRYLATE-CONTAINING UP OR VE RESIN Akzo Nobel Chemicals International B.V. (NL) 2016-12-21 EP disclosed
WO-2015121178-A1 PROCESS FOR CURING (METH)ACRYLATE-CONTAINING UP OR VE RESIN AKZO NOBEL CHEMICALS INTERNATIONAL B.V. (NL) 2015-08-20 WO disclosed