SCHEMBL21113632

SCHEMBL21113632

CCC(=O)c1cccc(/C(CC)=N/c2ccccc2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
ACMSD Q8TDX5 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAPT P10636 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 1/20 0.36
ATM Q13315 1/20 0.36
RIPK1 Q13546 3/20 0.36
POLB P06746 1/20 0.36
NOS3 P29474 4/20 0.35
NOS1 P29475 4/20 0.35
NOS2 P35228 2/20 0.35
ADORA3 P0DMS8 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA2B P29275 1/20 0.33
ADORA1 P30542 1/20 0.33

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
SCHEMBL21113630 0.85 CYP1A2 (0.39) CYP1A2KDM4EALOX15TSHRACMSD
SCHEMBL21113649 0.81 CYP1A2 (0.41) CYP1A2KDM4EALOX15TSHRACMSD
SCHEMBL1596880 0.80 CYP1A2 (0.55) CYP1A2KDM4EALOX15TSHRACMSD
SCHEMBL14821586 0.77 CYP1A2 (0.36) CYP1A2KDM4EALOX15TSHRACMSD
SCHEMBL21113719 0.76 SMN1; SMN2 (0.39) CYP1A2KDM4EMAPTSMN1; SMN2L3MBTL1
SCHEMBL21113645 0.75 CYP1A2 (0.38) CYP1A2KDM4EALOX15TSHRACMSD
SCHEMBL21113631 0.71 BRD4 (0.39) CYP1A2KDM4EALOX15TSHRACMSD
SCHEMBL30693375 0.70 P2RX7 (0.59) CYP1A2KDM4EALOX15TSHRACMSD
SCHEMBL5067835 0.70 P2RX7 (0.59) CYP1A2KDM4EALOX15TSHRACMSD
SCHEMBL13545046 0.70 CYP1A2 (0.44) CYP1A2KDM4EALOX15TSHRACMSD

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