SCHEMBL3142256

SCHEMBL3142256

CCOC(=O)C(C)(C)/N=N/C(C)(C)C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.41
MMP8 P22894 2/20 0.41
KDM4E B2RXH2 1/20 0.40
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
CYP4F2 P78329 3/20 0.39
CYP4A11 Q02928 3/20 0.39
THRB P10828 1/20 0.39
HTT P42858 1/20 0.38
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPT P10636 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ABCB11 O95342 1/20 0.35

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
SCHEMBL3142260 1.00 PKM (0.41) PKMMMP8KDM4EMGAMGAA
SCHEMBL1713464 0.91 CYP4F2 (0.44) PKMMMP8KDM4EMGAMGAA
SCHEMBL530506 0.91 CYP4F2 (0.44) PKMMMP8KDM4EMGAMGAA
SCHEMBL28678 0.84 DGAT1 (0.44) ALDH1A1MAPTCYP3A4TSHRDGAT1
SCHEMBL28677 0.84 DGAT1 (0.44) ALDH1A1MAPTCYP3A4TSHRDGAT1
SCHEMBL14299531 0.84 DGAT1 (0.44) ALDH1A1MAPTCYP3A4TSHRDGAT1
SCHEMBL11725731 0.83 MGAM (0.39) PKMMMP8KDM4EMGAMGAA
SCHEMBL3937564 0.83 MGAM (0.39) PKMMMP8KDM4EMGAMGAA
SCHEMBL22098178 0.80 PKM (0.42) PKMMMP8KDM4EMGAMGAA
SCHEMBL17280884 0.78 DGAT1 (0.39) ALDH1A1DGAT1

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-20100004349-A1 METHOD FOR PRODUCTION OF THERMOPLASTIC FOAMS ARKEMA FRANCE (FR) 2010-01-07 US disclosed