SCHEMBL5082873

SCHEMBL5082873

C=CCC(C(=O)OCC)C(CC)OC(=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
NPC1 O15118 2/20 0.43
LMNA P02545 1/20 0.40
OPRD1 P41143 1/20 0.40
ALDH1A1 P00352 4/20 0.40
MAPT P10636 2/20 0.40
PRKCA P17252 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
RAB9A P51151 2/20 0.39
GAA P10253 1/20 0.39
TSHR P16473 2/20 0.39
TP53 P04637 1/20 0.39
MAPK1 P28482 2/20 0.38
PIN1 Q13526 1/20 0.38
KDM4E B2RXH2 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL5082902 0.90 LMNA (0.41) MEN1KMT2ANPC1LMNAOPRD1
SCHEMBL5085898 0.86 NPC1 (0.49) MEN1KMT2ANPC1LMNAALDH1A1
SCHEMBL5082878 0.86 MEN1 (0.43) MEN1KMT2ANPC1LMNAOPRD1
SCHEMBL5082230 0.86 MEN1 (0.43) MEN1KMT2ANPC1LMNAOPRD1
SCHEMBL5085827 0.83 LMNA (0.46) MEN1KMT2ANPC1LMNAALDH1A1
SCHEMBL5082107 0.82 MMP8 (0.47) MEN1KMT2ANPC1LMNAALDH1A1
SCHEMBL5079895 0.82 KMT2A (0.44) MEN1KMT2ANPC1LMNAALDH1A1
SCHEMBL5082105 0.81 LMNA (0.42) MEN1KMT2ANPC1LMNAALDH1A1
SCHEMBL5082103 0.81 LMNA (0.42) MEN1KMT2ANPC1LMNAALDH1A1
SCHEMBL5086230 0.81 MEN1 (0.44) MEN1KMT2ANPC1LMNAALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1746110-B1 CATALYST COMPONENT FOR OLEFIN POLYMERIZATION REACTION AND CATALYST THEREOF CHINA PETROLEUM & CHEMICAL (CN) 2015-03-11 EP disclosed
US-7351778-B2 Catalyst component for olefin polymerization and catalyst comprising the same CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2008-04-01 US disclosed
EP-1746110-A1 CATALYST COMPONENT FOR OLEFIN POLYMERIZATION REACTION AND CATALYST THEREOF China Petroleum & Chemical Corporation (CN) 2007-01-24 EP disclosed
US-20060287446-A1 Catalyst component for olefin polymerization and catalyst comprising the same BEIJING RESEARCH INSTITUTE OF CHEMICAL INDUSTRY CHINA PETROLEUM & CHEMICAL COPORATION (CN) 2006-12-21 US disclosed