SCHEMBL4558728

SCHEMBL4558728

CC1(C)NC(=O)NC1=O.CC1(C)NC(=O)NC1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
MMP2 P08253 2/20 0.36
MMP9 P14780 2/20 0.36
CACNA1F O60840 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
CYP2C9 P11712 1/20 0.36
HTR2A P28223 1/20 0.36
HRH1 P35367 1/20 0.36
SCN1A P35498 1/20 0.36
SCN4A P35499 1/20 0.36
BLM P54132 1/20 0.36
PMP22 Q01453 1/20 0.36
CACNA1D Q01668 1/20 0.36
KCNH2 Q12809 1/20 0.36
CACNA1S Q13698 1/20 0.36
CACNA1C Q13936 1/20 0.36
SCN5A Q14524 1/20 0.36
SCN2A Q99250 1/20 0.36
SCN3A Q9NY46 1/20 0.36

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
SCHEMBL22069 1.00
SCHEMBL6278824 0.97 LMNA (0.36) LMNAMMP2MMP9CACNA1FALDH1A1
SCHEMBL6162987 0.97 LMNA (0.36) LMNAMMP2MMP9CACNA1FALDH1A1
Methyl Alcohol SCHEMBL7188450 0.94 MMP2 (0.35) LMNAMMP2MMP9CACNA1FALDH1A1
Formaldehyde SCHEMBL1396256 0.94 LMNA (0.35) LMNAMMP2MMP9CACNA1FALDH1A1
Butadiene SCHEMBL1304779 0.87 GAA (0.32) LMNAMMP2MMP9CACNA1FALDH1A1
Ethylene Glycol SCHEMBL6848838 0.87 LMNA (0.36) LMNAMMP2MMP9POLBSMN1; SMN2
SCHEMBL3176115 0.85 ADAMTS5 (0.32) LMNAMMP2POLBAKR1B1
SCHEMBL10527679 0.85 AKR1B1 (0.31) LMNAAKR1B1
Biphenyl SCHEMBL1304543 0.82 MMP2 (0.48) MMP2MMP9CACNA1FALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7557175-B2 Poly(carbonate-co-urea) copolymers and melt transesterification method of preparing these copolymers SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2009-07-07 US disclosed