SCHEMBL23509679

SCHEMBL23509679

c1ccc(-c2nc3ccccn3c2-c2cccc(N(c3ccccc3)c3ccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)cc3)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKT1 P31749 5/20 0.38
▸ AKT2 P31751 3/20 0.38
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ ATM Q13315 2/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ CASP3 P42574 1/20 0.33
▸ SENP8 Q96LD8 1/20 0.33
▸ SENP7 Q9BQF6 1/20 0.33
▸ SENP6 Q9GZR1 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ GRIA1 P42261 1/20 0.33
▸ NR1I2 O75469 1/20 0.32
▸ NR1I3 Q14994 1/20 0.32
▸ ADRA1B P35368 1/20 0.32
▸ NTRK1 P04629 1/20 0.32
▸ MGAM O43451 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ SI P14410 1/20 0.32
▸ MGAM2 Q2M2H8 1/20 0.32

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
SCHEMBL23509727 0.96 AKT1 (0.38) AKT1AKT2NPC1RAB9AATM
SCHEMBL23509711 0.95 AKT1 (0.42) AKT1AKT2NPC1RAB9AATM
SCHEMBL23509624 0.95 AKT1 (0.42) AKT1AKT2NPC1RAB9AATM
SCHEMBL23509734 0.91 AKT1 (0.38) AKT1AKT2NPC1RAB9AATM
SCHEMBL22673682 0.90 AKT1 (0.43) AKT1AKT2NPC1RAB9AATM
SCHEMBL23509625 0.90 AKT1 (0.42) AKT1AKT2NPC1RAB9AATM
SCHEMBL23509716 0.90 AKT1 (0.42) AKT1AKT2NPC1RAB9AATM
SCHEMBL22673680 0.89 AKT1 (0.44) AKT1AKT2NPC1RAB9AATM
SCHEMBL23509791 0.89 AKT1 (0.43) AKT1AKT2NPC1RAB9AATM
SCHEMBL23509743 0.89 AKT1 (0.43) AKT1AKT2NPC1RAB9AATM

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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