SCHEMBL5083451

SCHEMBL5083451

C=CCC(C(=O)OC)C(C)OC(=O)/C=C/c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
LMNA P02545 2/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CASP1 P29466 1/20 0.43
MMP1 P03956 1/20 0.42
AKR1B10 O60218 2/20 0.42
AKR1B1 P15121 2/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
ATM Q13315 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
NR1H4 Q96RI1 1/20 0.39

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
SCHEMBL5083454 1.00 ALDH1A1 (0.44) ALDH1A1LMNAMEN1KMT2ACASP1
SCHEMBL5079930 0.90 AKR1B10 (0.47) ALDH1A1LMNAMEN1KMT2ACASP1
SCHEMBL5079932 0.90 AKR1B10 (0.47) ALDH1A1LMNAMEN1KMT2ACASP1
SCHEMBL5082126 0.89 ALDH1A1 (0.44) ALDH1A1LMNAMEN1KMT2ACASP1
SCHEMBL5082122 0.89 ALDH1A1 (0.44) ALDH1A1LMNAMEN1KMT2ACASP1
SCHEMBL5941378 0.89 KMT2A (0.46) ALDH1A1LMNAMEN1KMT2ACASP1
SCHEMBL5941381 0.89 KMT2A (0.46) ALDH1A1LMNAMEN1KMT2ACASP1
SCHEMBL5085903 0.88 ALDH1A1 (0.43) ALDH1A1LMNAMEN1KMT2ACASP1
SCHEMBL5085907 0.88 ALDH1A1 (0.43) ALDH1A1LMNAMEN1KMT2ACASP1
SCHEMBL5083403 0.86 ALDH1A1 (0.47) ALDH1A1LMNAMEN1KMT2AMMP1

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