SCHEMBL6287625

SCHEMBL6287625

CCNCCOCCNC(=O)NC

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
EPHX2 P34913 3/20 0.40
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
FBP1 P09467 1/20 0.34
ACHE P22303 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SAT1 P21673 1/20 0.33
EPHX1 P07099 2/20 0.32
TSHR P16473 1/20 0.32
MTNR1A P48039 1/20 0.32

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
SCHEMBL6289721 0.98 KMT2A (0.43) KMT2AMEN1EPHX2KEAP1NFE2L2
SCHEMBL19171879 0.88 KMT2A (0.48) KMT2AMEN1EPHX2KEAP1NFE2L2
SCHEMBL6290261 0.86 MEN1 (0.41) KMT2AMEN1EPHX2FBP1SMN1; SMN2
SCHEMBL13411699 0.86 KMT2A (0.52) KMT2AMEN1EPHX2KEAP1NFE2L2
SCHEMBL6280459 0.85 MAPT (0.43) EPHX2KEAP1NFE2L2MAPTHSD17B10
SCHEMBL6290266 0.85 MEN1 (0.44) KMT2AMEN1EPHX2FBP1SMN1; SMN2
SCHEMBL19171981 0.85 MEN1 (0.44) KMT2AMEN1EPHX2KEAP1NFE2L2
SCHEMBL24286829 0.84 EPHX2 (0.53) KMT2AMEN1EPHX2KEAP1NFE2L2
SCHEMBL6287724 0.84 EPHX1 (0.44) EPHX2ACHESMN1; SMN2EPHX1TSHR
SCHEMBL22861950 0.83 EPHX1 (0.46) KMT2AMEN1EPHX2SMN1; SMN2EPHX1

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