SCHEMBL4612254

SCHEMBL4612254

C=CCOC(=O)N(CC(CC)C(=O)OCC)[C@@H](C)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.34
EPHX2 P34913 1/20 0.32
PPARG P37231 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
HSD17B10 Q99714 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL4803335 0.87 L3MBTL1 (0.40) EPHX2PPARGALDH1A1LMNAPOLB
SCHEMBL4803342 0.87 L3MBTL1 (0.40) EPHX2PPARGALDH1A1LMNAPOLB
SCHEMBL4804598 0.82 EPHX2 (0.35) EPHX2PPARGALDH1A1LMNAPOLB
SCHEMBL4804601 0.82 EPHX2 (0.35) EPHX2PPARGALDH1A1LMNAPOLB
SCHEMBL4805760 0.78 NFKB1 (0.33) EPHX2PPARGALDH1A1LMNAPOLB
SCHEMBL4805755 0.78 NFKB1 (0.33) EPHX2PPARGALDH1A1LMNAPOLB
SCHEMBL4796480 0.76 ALDH1A1 (0.49) EPHX2PPARGALDH1A1LMNAPOLB
SCHEMBL4612257 0.74 TSHR (0.47) TDP1EPHX2ALDH1A1LMNAHSD17B10
SCHEMBL29404427 0.73 TSHR (0.48) TDP1EPHX2ALDH1A1LMNATSHR
SCHEMBL28338208 0.73 TSHR (0.48) TDP1EPHX2ALDH1A1LMNATSHR

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-1833788-B1 PROCESS FOR PREPARING PERINDOPRIL ERBUMINE SINT QUIMICA SA (ES) 2008-04-16 EP disclosed
EP-1833788-A1 PROCESS FOR PREPARING PERINDOPRIL ERBUMINE Quimica Sintetica, S.A. (ES) 2007-09-19 EP disclosed
WO-2006070276-A1 PROCESS FOR PREPARING PERINDOPRIL ERBUMINE QUIMICA SINTETICA, S.A. (ES) 2006-07-06 WO disclosed