SCHEMBL29145182

SCHEMBL29145182

CCC(C)COC(=O)n1cnc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ MAPT P10636 3/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ ASAH1 Q13510 5/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ APAF1 O14727 1/20 0.45
▸ MEN1 O00255 1/20 0.43
▸ HTT P42858 2/20 0.41
▸ ADRB2 P07550 1/20 0.41
▸ ADRB1 P08588 1/20 0.41
▸ ADRB3 P13945 1/20 0.41
▸ LMNA P02545 3/20 0.41
▸ TSHR P16473 1/20 0.41
▸ STAT6 P42226 1/20 0.40
▸ POLB P06746 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
SCHEMBL29145136 0.88 ALDH1A1 (0.52) SMN1; SMN2MAPTALDH1A1NPC1HPGD
SCHEMBL29145104 0.84 ALDH1A1 (0.55) SMN1; SMN2MAPTALDH1A1NPC1HPGD
SCHEMBL29145185 0.81 SMN1; SMN2 (0.45) SMN1; SMN2MAPTALDH1A1NPC1HPGD
SCHEMBL29145099 0.81 ASAH1 (0.53) SMN1; SMN2MAPTALDH1A1NPC1HPGD
SCHEMBL29145145 0.80 SMN1; SMN2 (0.49) SMN1; SMN2MAPTALDH1A1NPC1HPGD
SCHEMBL20522520 0.79 SMN1; SMN2 (0.51) SMN1; SMN2MAPTALDH1A1NPC1HPGD
SCHEMBL722366 0.78 ASAH1 (0.57) SMN1; SMN2MAPTALDH1A1NPC1HPGD
SCHEMBL29145133 0.77 ASAH1 (0.60) SMN1; SMN2MAPTALDH1A1NPC1HPGD
SCHEMBL10504808 0.77 ASAH1 (0.47) SMN1; SMN2MAPTALDH1A1NPC1HPGD
SCHEMBL8744445 0.76 ASAH1 (0.62) SMN1; SMN2MAPTALDH1A1NPC1HPGD

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
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