SCHEMBL20165510

SCHEMBL20165510

CCCCN(C(=O)OCC)C(CC)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
HSD17B10 Q99714 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CA2 P00918 2/20 0.35
MAPK1 P28482 1/20 0.35
CA1 P00915 2/20 0.33
EPHX2 P34913 1/20 0.32
KDM4C Q9H3R0 3/20 0.32
KDM4A O75164 1/20 0.32
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
KDM5A P29375 3/20 0.31
SLC1A3 P43003 1/20 0.31
SLC1A2 P43004 1/20 0.31
SLC1A1 P43005 1/20 0.31
GPR84 Q9NQS5 3/20 0.31
FFAR1 O14842 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
SCHEMBL28694316 0.94 ALDH1A1 (0.39) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL28701714 0.89 HSD17B10 (0.43) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL28870468 0.88 ALDH1A1 (0.39) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL11125730 0.87 ALDH1A1 (0.42) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL31126832 0.86 L3MBTL1 (0.33) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL28932263 0.83 GPR84 (0.39) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL28701708 0.83 GPR84 (0.39) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL20166069 0.82 HSD17B10 (0.40) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL28870496 0.82 EPHX2 (0.37) ALDH1A1LMNAPOLBHSD17B10L3MBTL1
SCHEMBL5821827 0.81 ALDH1A1 (0.45) 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
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
EP-3541857-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2019-09-25 EP disclosed
WO-2018091375-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2018-05-24 WO disclosed