SCHEMBL6284516

SCHEMBL6284516

CNCCCCCCNC(N)=O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
MAPK1 P28482 1/20 0.48
HIF1A Q16665 1/20 0.48
PAOX Q6QHF9 2/20 0.45
EPHX1 P07099 7/20 0.44
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM4A O75164 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
CASP2 P42575 1/20 0.39
ADRA1A P35348 1/20 0.39
ALDH1A2 O94788 1/20 0.38
ALDH2 P05091 1/20 0.38
ALDH1A3 P47895 1/20 0.38

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
SCHEMBL6284235 0.98 KDM4E (0.44) KDM4EMAPK1HIF1APAOXEPHX1
SCHEMBL6285701 0.93
Urea SCHEMBL28214731 0.91 KDM4E (0.37) KDM4EMAPK1HIF1APAOXEPHX1
SCHEMBL28622543 0.87 KDM4E (0.52) KDM4EMAPK1HIF1APAOXEPHX1
SCHEMBL1839119 0.87 KDM4E (0.52) KDM4EMAPK1HIF1APAOXEPHX1
SCHEMBL1309360 0.87 KDM4E (0.52) KDM4EMAPK1HIF1APAOXEPHX1
SCHEMBL1837168 0.87 KDM4E (0.52) KDM4EMAPK1HIF1APAOXEPHX1
SCHEMBL11180722 0.87 KDM4E (0.52) KDM4EMAPK1HIF1APAOXEPHX1
SCHEMBL11173620 0.87 KDM4E (0.52) KDM4EMAPK1HIF1APAOXEPHX1
SCHEMBL28560371 0.87 KDM4E (0.52) KDM4EMAPK1HIF1APAOXEPHX1

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
EP-2938596-B1 METHODS FOR PURIFICATION OF SERINE PROTEASES PORTOLA PHARM INC (US) 2017-11-01 EP disclosed
US-6916854-B2 Heat and/or light curable films or coatings comprising polyurethanes or polyureaurethane copolymers having storage stability, used as automobile paints BASF AKTIENGESELLSCHAFT (DE) 2005-07-12 US disclosed
US-20040097642-A1 Unsaturated compounds containing carbamate terminal groups or urea terminal groups BASF AKTIENGESELLSCHAFT (DE) 2004-05-20 US disclosed