SCHEMBL23509637

SCHEMBL23509637

Cc1ccc(N(c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc3)cc2)c2ccc(-c3c(-c4ccccc4)nc4ccccn34)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.53
▸ TP53 P04637 2/20 0.53
▸ ALDH1A1 P00352 4/20 0.52
▸ NPC1 O15118 3/20 0.52
▸ RAB9A P51151 3/20 0.52
▸ AKT1 P31749 3/20 0.52
▸ AKT2 P31751 3/20 0.52
▸ MAPK1 P28482 1/20 0.47
▸ USP7 Q93009 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ ADORA1 P30542 1/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.44
▸ ADRA1B P35368 1/20 0.44

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
SCHEMBL23509740 1.00 MAPT (0.53) MAPTTP53ALDH1A1NPC1RAB9A
SCHEMBL23509706 0.93 AKT1 (0.57) MAPTTP53ALDH1A1NPC1RAB9A
SCHEMBL23509788 0.93 AKT1 (0.57) MAPTTP53ALDH1A1NPC1RAB9A
SCHEMBL23509697 0.93 AKT1 (0.57) MAPTTP53ALDH1A1NPC1RAB9A
SCHEMBL23509738 0.92 AKT1 (0.56) MAPTTP53ALDH1A1NPC1RAB9A
SCHEMBL23509647 0.92 AKT1 (0.56) MAPTTP53ALDH1A1NPC1RAB9A
SCHEMBL23509742 0.92 AKT1 (0.56) MAPTTP53ALDH1A1NPC1RAB9A
SCHEMBL23509799 0.92 AKT1 (0.56) MAPTTP53ALDH1A1NPC1RAB9A
SCHEMBL23509623 0.92 AKT1 (0.56) MAPTTP53ALDH1A1NPC1RAB9A
SCHEMBL25790017 0.92 ALDH1A1 (0.59) MAPTTP53ALDH1A1NPC1RAB9A

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
WO-2021114801-A1 IMIDAZOPYRIDINE-BASED ARYLAMINE COMPOUND AND USE THEREOF 广东阿格蕾雅光电材料有限公司 2021-06-17 — — WO disclosed
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