SCHEMBL21113656

SCHEMBL21113656

CCCCCC/N=C(\C)c1cccc(C(=O)CC)n1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
NPC1 O15118 2/20 0.38
TSHR P16473 2/20 0.38
RAB9A P51151 2/20 0.38
KCNH2 Q12809 1/20 0.38
HTT P42858 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.38
FAAH O00519 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 1/20 0.37
ATM Q13315 1/20 0.37
CYP1A2 P05177 1/20 0.36
SCNN1A P37088 2/20 0.35
TLR8 Q9NR97 1/20 0.34

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
SCHEMBL21113668 0.94 CYP1A2 (0.38) ALDH1A1NPC1TSHRRAB9AKCNH2
SCHEMBL18543916 0.90 KCNH2 (0.46) ALDH1A1NPC1TSHRRAB9AKCNH2
SCHEMBL12338693 0.90 KCNH2 (0.46) ALDH1A1NPC1TSHRRAB9AKCNH2
SCHEMBL21113647 0.89 ALDH1A1 (0.41) ALDH1A1NPC1TSHRRAB9AKCNH2
SCHEMBL24404244 0.89 KCNH2 (0.40) ALDH1A1NPC1TSHRRAB9AKCNH2
SCHEMBL21113705 0.89 KCNH2 (0.40) ALDH1A1NPC1TSHRRAB9AKCNH2
SCHEMBL24404246 0.89 KCNH2 (0.40) ALDH1A1NPC1TSHRRAB9AKCNH2
SCHEMBL21113686 0.89 KCNH2 (0.40) ALDH1A1NPC1TSHRRAB9AKCNH2
SCHEMBL18543908 0.88 KCNH2 (0.43) ALDH1A1NPC1TSHRRAB9AKCNH2
SCHEMBL24404248 0.87 TSHR (0.40) ALDH1A1NPC1TSHRRAB9AKCNH2

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