SCHEMBL24701466

SCHEMBL24701466

CN(C)c1ccc(/C=C/c2nc3ccccc3[nH]c2=O)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 9/20 0.72
▸ KMT2A Q03164 9/20 0.72
▸ MEN1 O00255 8/20 0.72
▸ NPC1 O15118 7/20 0.72
▸ KDM4E B2RXH2 6/20 0.72
▸ MAPT P10636 6/20 0.72
▸ ALDH1A1 P00352 4/20 0.72
▸ L3MBTL1 Q9Y468 2/20 0.70
▸ GAA P10253 1/20 0.70
▸ TDP1 Q9NUW8 1/20 0.70
▸ KLF5 Q13887 1/20 0.58
▸ FGFR1 P11362 3/20 0.56
▸ PDGFRB P09619 2/20 0.55
▸ FGFR3 P22607 1/20 0.55
▸ MGAM O43451 1/20 0.53
▸ TLR9 Q9NR96 1/20 0.50
▸ HPGD P15428 1/20 0.49
▸ MCL1 Q07820 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ RXFP1 Q9HBX9 1/20 0.49

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
SCHEMBL7105109 0.85 RAB9A (0.78) RAB9AKMT2AMEN1NPC1KDM4E
SCHEMBL6936350 0.85 RAB9A (0.78) RAB9AKMT2AMEN1NPC1KDM4E
SCHEMBL28465286 0.84 KMT2A (1.00) RAB9AKMT2AMEN1NPC1KDM4E
SCHEMBL25721073 0.83 NPC1 (0.60) RAB9AKMT2AMEN1NPC1KDM4E
SCHEMBL28472852 0.81 NPC1 (0.52) RAB9AKMT2AMEN1NPC1KDM4E
SCHEMBL25721116 0.81 MEN1 (0.53) RAB9AKMT2AMEN1NPC1KDM4E
SCHEMBL31252953 0.81 MAPT (0.71) RAB9AKMT2AMEN1NPC1KDM4E
SCHEMBL2497904 0.81 MAPT (0.71) RAB9AKMT2AMEN1NPC1KDM4E
SCHEMBL2497906 0.81 MAPT (0.71) RAB9AKMT2AMEN1NPC1KDM4E
SCHEMBL10371974 0.80 RELA (0.63) RAB9AKMT2AMEN1NPC1KDM4E

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
US-20220390426-A1 AIE PROBE AND APPLICATION THEREOF THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2022-12-08 — — US disclosed
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