SCHEMBL21113709

SCHEMBL21113709

CC(=O)c1cccc(/C(C)=N/c2cnc3ccccc3c2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.47
CSNK1G2 P78368 1/20 0.47
CLK4 Q9HAZ1 1/20 0.47
MKNK2 Q9HBH9 1/20 0.47
MAP4K5 Q9Y4K4 1/20 0.47
RAB9A P51151 6/20 0.44
KDM4E B2RXH2 5/20 0.44
HSD17B10 Q99714 4/20 0.44
NPC1 O15118 4/20 0.44
HPGD P15428 3/20 0.44
ALDH1A1 P00352 3/20 0.44
TSHR P16473 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP1A2 P05177 2/20 0.43
MGAM O43451 1/20 0.42
PRKAG1 P54619 1/20 0.39
PRKAA1 Q13131 1/20 0.39
PRKAB1 Q9Y478 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
POLB P06746 2/20 0.38

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
SCHEMBL18543993 0.93 CYP1A2 (0.49) MAP4K4CSNK1G2CLK4MKNK2MAP4K5
SCHEMBL21113689 0.81 HTR3E (0.46) RAB9AKDM4ENPC1HPGDALDH1A1
SCHEMBL21113696 0.78 KDM4E (0.44) RAB9AKDM4EALDH1A1TSHRCYP1A2
SCHEMBL21113710 0.76 HSD17B10 (0.43) MAP4K4CSNK1G2CLK4MKNK2MAP4K5
SCHEMBL21192693 0.74 CYP1A2 (0.46) MAP4K4CSNK1G2CLK4MKNK2MAP4K5
SCHEMBL21192695 0.74 CYP1A2 (0.46) MAP4K4CSNK1G2CLK4MKNK2MAP4K5
SCHEMBL15890723 0.73 NOS3 (0.42) RAB9AKDM4ENPC1HPGDALDH1A1
SCHEMBL18543955 0.73 CYP1A2 (0.51) MAP4K4CSNK1G2CLK4MKNK2MAP4K5
SCHEMBL18543952 0.73 CYP1A2 (0.51) MAP4K4CSNK1G2CLK4MKNK2MAP4K5
SCHEMBL18543866 0.72 HTR3E (0.53) RAB9AKDM4ENPC1HPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3517555-B1 CATALYST COMPONENT FOR USE IN OLEFIN POLYMERIZATION, CATALYST, AND APPLICATIONS THEREOF CHINA PETROLEUM & CHEM CORP (CN) 2024-11-27 EP claimed
EP-3517555-A1 CATALYST COMPONENT FOR USE IN OLEFIN POLYMERIZATION, CATALYST, AND APPLICATIONS THEREOF China Petroleum&Chemical Corporation (CN) 2019-07-31 EP claimed
US-20190211119-A1 CATALYST COMPONENT FOR OLEFIN POLYMERIZATION, CATALYST, AND USE THEREOF BEIJING RESEARCH INSTITUTE OF CHEMICAL INDUSTRY, CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2019-07-11 US claimed
EP-3517555-B1 CATALYST COMPONENT FOR USE IN OLEFIN POLYMERIZATION, CATALYST, AND APPLICATIONS THEREOF CHINA PETROLEUM & CHEM CORP (CN) 2024-11-27 EP disclosed
US-11325994-B2 Catalyst component for olefin polymerization, catalyst, and use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2022-05-10 US disclosed
US-11325994-B2 Catalyst component for olefin polymerization, catalyst, and use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2022-05-10 US disclosed
EP-3517555-A1 CATALYST COMPONENT FOR USE IN OLEFIN POLYMERIZATION, CATALYST, AND APPLICATIONS THEREOF China Petroleum&Chemical Corporation (CN) 2019-07-31 EP disclosed
US-20190211119-A1 CATALYST COMPONENT FOR OLEFIN POLYMERIZATION, CATALYST, AND USE THEREOF BEIJING RESEARCH INSTITUTE OF CHEMICAL INDUSTRY, CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2019-07-11 US disclosed