SCHEMBL21113666

SCHEMBL21113666

CC(=O)c1cccc(/C(C)=N/c2ccc(Cl)cc2)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
CRHR1 P34998 2/20 0.39
GAA P10253 2/20 0.39
KDM1A O60341 2/20 0.38
OPRK1 P41145 2/20 0.38
AGTR1 P30556 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TDP1 Q9NUW8 2/20 0.38
CYP2C19 P33261 2/20 0.38
HTR3E A5X5Y0 1/20 0.38
SLC22A2 O15244 1/20 0.38
SLC22A1 O15245 1/20 0.38
SLC22A3 O75751 1/20 0.38
HTR3B O95264 1/20 0.38
PLAU P00749 1/20 0.38
CYP2D6 P10635 1/20 0.38
HTR3A P46098 1/20 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
SCHEMBL24404236 1.00 PTGS1 (0.40) PTGS1PTGS2NPC1RAB9ACRHR1
SCHEMBL18543921 0.92 HTR3E (0.44) PTGS1PTGS2NPC1RAB9ACRHR1
SCHEMBL18544048 0.87 NOS3 (0.41) NPC1RAB9ACRHR1GAAOPRK1
SCHEMBL15890723 0.86 NOS3 (0.42) NPC1RAB9AGAAKDM1ATDP1
SCHEMBL21113696 0.85 KDM4E (0.44) PTGS1PTGS2RAB9ACRHR1TDP1
SCHEMBL21113674 0.82 PLAU (0.44) NPC1RAB9AGAAOPRK1L3MBTL1
SCHEMBL24187390 0.82 MEN1 (0.49) NPC1RAB9AGAAHTR3EHTR3B
SCHEMBL21239593 0.82 CRHR1 (0.39) PTGS1PTGS2NPC1RAB9ACRHR1
SCHEMBL24404239 0.81 KDM1A (0.37) PTGS1PTGS2NPC1RAB9AGAA
SCHEMBL21113711 0.81 KDM1A (0.37) PTGS1PTGS2NPC1RAB9AGAA

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 7 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
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