SCHEMBL21113629

SCHEMBL21113629

CC(=O)c1cccc(CC=Nc2c(C)cccc2C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.41
MAOA P21397 1/20 0.40
IL4I1 Q96RQ9 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
EPHX1 P07099 1/20 0.38
ALDH1A1 P00352 3/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CDKN1A P38936 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
F10 P00742 1/20 0.37
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL21239597 0.83 ATM (0.37) CYP3A4CYP2D6CYP2C9ALDH1A1KMT2A
SCHEMBL21113635 0.82 EPHX1 (0.39) MAOBMAOAIL4I1NPC1RAB9A
SCHEMBL21113692 0.81 MAOB (0.48) MAOBMAOAIL4I1NPC1RAB9A
SCHEMBL1071465 0.76 MAOB (0.41) MAOBALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL18489528 0.76 MAOB (0.41) MAOBALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL12253688 0.76 MAOB (0.50) MAOBMAOAIL4I1NPC1RAB9A
SCHEMBL21113673 0.76 KMT2A (0.49) MAOBMAOAIL4I1NPC1RAB9A
SCHEMBL21113665 0.75 MAOB (0.48) MAOBMAOAIL4I1NPC1RAB9A
SCHEMBL22227443 0.75 MAOB (0.49) MAOBMAOAIL4I1NPC1RAB9A
SCHEMBL28879940 0.73 MAOB (0.47) MAOBMAOAIL4I1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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