SCHEMBL18249376

SCHEMBL18249376

C[CH]CC(C)N(CCCC)C(=O)OCC

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
HSD17B10 Q99714 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
EPHX2 P34913 1/20 0.33
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP3 P08254 1/20 0.32
MMP8 P22894 1/20 0.32
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA9 Q16790 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL21159624 0.83 ALDH1A1 (0.40) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL21081854 0.83 ALDH1A1 (0.36) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL20168886 0.79 ALDH1A1 (0.37) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL28482683 0.79 ALDH1A1 (0.40) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL21522901 0.76 DNM1 (0.36) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL6287606 0.76 ALDH1A1 (0.45) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL5821830 0.76 ALDH1A1 (0.45) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL5821827 0.76 ALDH1A1 (0.45) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL18256246 0.75 MMP1 (0.33) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL20165986 0.74 ALDH1A1 (0.41) ALDH1A1LMNAPOLBHSD17B10L3MBTL1

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-3298048-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2018-03-28 EP disclosed
CN-107580607-A CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS 巴塞尔聚烯烃意大利有限公司 2018-01-12 CN disclosed
WO-2016184884-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2016-11-24 WO disclosed