SCHEMBL11049035

SCHEMBL11049035

C/C(N)=C/C(=O)NCCO

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 2/20 0.37
USP2 O75604 1/20 0.37
RBP4 P02753 1/20 0.34
CNR1 P21554 3/20 0.33
GAA P10253 1/20 0.33
CNR2 P34972 2/20 0.31
TRPM8 Q7Z2W7 1/20 0.31
FAAH O00519 1/20 0.31
KCNK3 O14649 1/20 0.31
BLM P54132 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ZDHHC20 Q5W0Z9 1/20 0.31

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
SCHEMBL11049989 0.89 ALDH1A1 (0.40) ALDH1A1HPGDSMN1; SMN2MAPTUSP2
SCHEMBL11052618 0.84 KDM4E (0.46) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL11047731 0.83 KDM4E (0.50) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL11048988 0.83 KDM4E (0.50) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL10157162 0.82 SMN1; SMN2 (0.52) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL11488086 0.79 ZDHHC20 (0.48) MAPTZDHHC20ZDHHC2
SCHEMBL15780411 0.77
SCHEMBL11596725 0.75 MAPT (0.36) ALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL7383145 0.74 CTH (0.40) ALDH1A1HPGDSMN1; SMN2MAPTFAAH
SCHEMBL29709575 0.74 ALDH1A1 (0.37) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4424336-A Meat-curable mixture, which are stable on storage, of epoxide resin, 3-aminocrotonic acid derivatives and maleimide compound CIBA-GEIGY CORPORATION (US) 1984-01-03 US disclosed
US-4360655-A Heat-curable mixtures, which are stable on storage, of epoxide compounds β-aminocrotonic acid derivatives and polyamine CIBA-GEIGY CORPORATION (US) 1982-11-23 US disclosed
US-4291146-A Heat-curable mixtures, which are stable on storage, of expoxide resins and β-aminocrotonic acid derivatives CIBA-GEIGY CORPORATION (US) 1981-09-22 US disclosed