SCHEMBL29145145

SCHEMBL29145145

CC(C)CCOC(=O)n1cnc2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.49
ASAH1 Q13510 6/20 0.48
KMT2A Q03164 3/20 0.47
APAF1 O14727 1/20 0.46
ALDH1A1 P00352 2/20 0.45
NPC1 O15118 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
RAB9A P51151 1/20 0.45
HSD17B10 Q99714 1/20 0.45
MEN1 O00255 1/20 0.44
HTT P42858 2/20 0.42
LMNA P02545 1/20 0.41
STAT6 P42226 1/20 0.41
DNMT3A Q9Y6K1 1/20 0.40
EGLN3 Q9H6Z9 1/20 0.40

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
SCHEMBL10504808 0.91 ASAH1 (0.47) SMN1; SMN2ASAH1KMT2AAPAF1ALDH1A1
SCHEMBL29145136 0.86 ALDH1A1 (0.52) SMN1; SMN2ASAH1KMT2AAPAF1ALDH1A1
SCHEMBL29145099 0.85 ASAH1 (0.53) SMN1; SMN2ASAH1KMT2AALDH1A1NPC1
SCHEMBL29145104 0.83 ALDH1A1 (0.55) SMN1; SMN2ASAH1KMT2AALDH1A1NPC1
SCHEMBL722366 0.82 ASAH1 (0.57) SMN1; SMN2ASAH1KMT2AALDH1A1NPC1
SCHEMBL29145133 0.81 ASAH1 (0.60) SMN1; SMN2ASAH1KMT2AALDH1A1NPC1
SCHEMBL29145161 0.80 ASAH1 (0.62) SMN1; SMN2ASAH1KMT2AALDH1A1NPC1
SCHEMBL8744445 0.80 ASAH1 (0.62) SMN1; SMN2ASAH1KMT2AALDH1A1NPC1
SCHEMBL29145182 0.80 SMN1; SMN2 (0.48) SMN1; SMN2ASAH1KMT2AAPAF1ALDH1A1
SCHEMBL20522520 0.80 SMN1; SMN2 (0.51) SMN1; SMN2ASAH1KMT2AALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117430738-A Catalyst component for olefin polymerization, catalyst and application thereof 中国石油化工股份有限公司 2024-01-23 CN claimed
CN-117430737-A Catalyst component for olefin polymerization, catalyst and application thereof 中国石油化工股份有限公司 2024-01-23 CN claimed
CN-117430738-A Catalyst component for olefin polymerization, catalyst and application thereof 中国石油化工股份有限公司 2024-01-23 CN disclosed
CN-117430737-A Catalyst component for olefin polymerization, catalyst and application thereof 中国石油化工股份有限公司 2024-01-23 CN disclosed