SCHEMBL29451235

SCHEMBL29451235

CCCCCCCN(c1ccccc1)c1ccccc1N(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 4/20 0.45
▸ NPC1 O15118 1/20 0.44
▸ JAK2 O60674 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ PAX8 Q06710 1/20 0.44
▸ SIGMAR1 Q99720 5/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ HTT P42858 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ MEN1 O00255 1/20 0.39
▸ CASP1 P29466 1/20 0.39
▸ BRCA1 P38398 1/20 0.39
▸ CASP7 P55210 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ TP53 P04637 1/20 0.38
▸ TACR1 P25103 1/20 0.38
▸ DHFR P00374 1/20 0.37
▸ CYP1A2 P05177 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
SCHEMBL11396663 0.93 HTT (0.46) KCNH2NPC1JAK2RAB9APAX8
SCHEMBL4559051 0.84 KCNH2 (0.46) KCNH2NPC1JAK2RAB9APAX8
SCHEMBL109304 0.84 KCNH2 (0.46) KCNH2NPC1JAK2RAB9APAX8
SCHEMBL28546509 0.84 KCNH2 (0.46) KCNH2NPC1JAK2RAB9APAX8
SCHEMBL3450720 0.84 KCNH2 (0.46) KCNH2NPC1JAK2RAB9APAX8
SCHEMBL10869649 0.84 KCNH2 (0.46) KCNH2NPC1JAK2RAB9APAX8
SCHEMBL7607872 0.84 KCNH2 (0.46) KCNH2NPC1JAK2RAB9APAX8
SCHEMBL986349 0.84 KCNH2 (0.46) KCNH2NPC1JAK2RAB9APAX8
SCHEMBL3451238 0.84 KCNH2 (0.46) KCNH2NPC1JAK2RAB9APAX8
SCHEMBL17440487 0.84 KCNH2 (0.46) KCNH2NPC1JAK2RAB9APAX8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114341246-A Use of a phenol-substituted sugar derivative as a stabilizer, a plastic composition, a method of stabilizing a plastic material and a phenol-substituted sugar derivative 弗劳恩霍夫应用研究促进协会 2022-04-12 — — CN disclosed
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