SCHEMBL21113634

SCHEMBL21113634

CC(=O)c1cccc(/C(C)=N/c2c(C(C)C)cccc2C(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
LMNA P02545 3/20 0.43
KCNK3 O14649 1/20 0.41
KCNK9 Q9NPC2 1/20 0.41
ALDH1A1 P00352 4/20 0.39
GAA P10253 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
RAB9A P51151 1/20 0.39
FURIN P09958 1/20 0.38
GABRA1 P14867 3/20 0.37
GABRB1 P18505 2/20 0.37
MEN1 O00255 1/20 0.37
HTT P42858 1/20 0.37
GABRG2 P18507 2/20 0.37
GABRB3 P28472 2/20 0.37
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
TDP1 Q9NUW8 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
SCHEMBL18544009 0.92 FURIN (0.43) KMT2ALMNAKCNK3KCNK9GAA
SCHEMBL1069879 0.82 LMNA (0.49) KMT2ALMNAALDH1A1GAASMN1; SMN2
SCHEMBL1069876 0.82 LMNA (0.49) KMT2ALMNAALDH1A1GAASMN1; SMN2
SCHEMBL1638478 0.81 NPC1 (0.48) ALDH1A1SMN1; SMN2NPC1RAB9ACYP1A2
SCHEMBL12726482 0.81 NPC1 (0.48) ALDH1A1SMN1; SMN2NPC1RAB9ACYP1A2
SCHEMBL1638479 0.81 NPC1 (0.48) ALDH1A1SMN1; SMN2NPC1RAB9ACYP1A2
SCHEMBL21113628 0.79 TDP1 (0.42) KMT2AKCNK3KCNK9ALDH1A1GAA
SCHEMBL1639374 0.75 CTSL (0.38) KMT2ALMNAGAASMN1; SMN2NPC1
SCHEMBL1639376 0.75 CTSL (0.38) KMT2ALMNAGAASMN1; SMN2NPC1
SCHEMBL12726481 0.75 CTSL (0.38) KMT2ALMNAGAASMN1; SMN2NPC1

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