SCHEMBL28870503

SCHEMBL28870503

CCCCCCN(C(=O)OCC)[C@H](C(=O)OCC)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.39
LMNA P02545 3/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
HSD17B10 Q99714 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 1/20 0.35
DNM1 Q05193 1/20 0.34
TSHR P16473 1/20 0.33
FAAH O00519 2/20 0.33
CPB2 Q96IY4 1/20 0.33
ZDHHC7 Q9NXF8 1/20 0.33
NAAA Q02083 1/20 0.33
DGKA P23743 1/20 0.33
CES2 O00748 1/20 0.33

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
SCHEMBL28695122 1.00 EPHX2 (0.39) EPHX2LMNAALDH1A1POLBHSD17B10
SCHEMBL28932264 1.00 EPHX2 (0.39) EPHX2LMNAALDH1A1POLBHSD17B10
SCHEMBL28870497 1.00 EPHX2 (0.39) EPHX2LMNAALDH1A1POLBHSD17B10
SCHEMBL28870494 0.94 ALDH1A1 (0.41) EPHX2LMNAALDH1A1POLBHSD17B10
SCHEMBL28679294 0.94 ALDH1A1 (0.41) EPHX2LMNAALDH1A1POLBHSD17B10
SCHEMBL28700846 0.93 EPHX2 (0.36) EPHX2LMNAALDH1A1POLBHSD17B10
SCHEMBL29579291 0.88 EPHX2 (0.37) EPHX2LMNAALDH1A1POLBHSD17B10
SCHEMBL22857416 0.88 EPHX2 (0.37) EPHX2LMNAALDH1A1POLBHSD17B10
SCHEMBL28699570 0.87 ALDH1A1 (0.40) LMNAALDH1A1POLBHSD17B10L3MBTL1
SCHEMBL28699568 0.87 ALDH1A1 (0.40) LMNAALDH1A1POLBHSD17B10L3MBTL1

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
CN-114026135-B Catalyst components for the polymerization of olefins 巴塞尔聚烯烃意大利有限公司 2022-11-01 CN disclosed
CN-114026135-A Catalyst components for the polymerization of olefins 巴塞尔聚烯烃意大利有限公司 2022-02-08 CN disclosed