SCHEMBL6285649

SCHEMBL6285649

CNCCOCCNC(N)=O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 2/20 0.33
EPHX2 P34913 2/20 0.33
CHEK1 O14757 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CA12 O43570 2/20 0.30
CA1 P00915 2/20 0.30
CA4 P22748 2/20 0.30
CA9 Q16790 2/20 0.30
CA14 Q9ULX7 2/20 0.30
FBP1 P09467 1/20 0.30
KDM4E B2RXH2 2/20 0.30
ALDH1A1 P00352 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
SCHEMBL6290115 0.98 MEN1 (0.47) CA2MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL8958454 0.89 CA2 (0.50) CA2MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL8958306 0.86 CA2 (0.53) CA2MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL8958443 0.86 CA2 (0.53) CA2MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL8958158 0.86 CA2 (0.53) CA2MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL8958384 0.86 CA2 (0.53) CA2MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL6284265 0.83 TSHR (0.39) CA2SMN1; SMN2EPHX2KDM4EALDH1A1
SCHEMBL19171420 0.83 CA2 (0.42) CA2MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL31482996 0.83 EPHX2 (0.46) CA2MEN1KMT2ASMN1; SMN2EPHX2
Ethylene Glycol SCHEMBL8958377 0.82 CA2 (0.46) CA2MEN1KMT2ASMN1; SMN2LMNA

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
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