SCHEMBL30038776

SCHEMBL30038776

Cc1ccc(-c2nc3ccccn3c2Cc2ccc(N(C)C)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.61
▸ TP53 P04637 2/20 0.61
▸ NPC1 O15118 5/20 0.52
▸ RAB9A P51151 5/20 0.52
▸ ALDH1A1 P00352 5/20 0.52
▸ SMN1; SMN2 Q16637 4/20 0.52
▸ KDM4E B2RXH2 4/20 0.52
▸ POLB P06746 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ MAPK1 P28482 3/20 0.47
▸ GAA P10253 3/20 0.47
▸ PKM P14618 2/20 0.47
▸ NPSR1 Q6W5P4 2/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ KCNK3 O14649 3/20 0.45
▸ KCNK9 Q9NPC2 3/20 0.45
▸ HPGD P15428 2/20 0.45
▸ GABRA1 P14867 2/20 0.45
▸ GABRB2 P47870 2/20 0.45
▸ LMNA P02545 1/20 0.45

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
SCHEMBL30039667 0.91 SMN1; SMN2 (0.52) MAPTTP53NPC1RAB9AALDH1A1
SCHEMBL30039276 0.89 ALDH1A1 (0.51) MAPTTP53NPC1RAB9AALDH1A1
SCHEMBL30039601 0.89 MAPT (0.59) MAPTTP53NPC1RAB9AALDH1A1
SCHEMBL30040119 0.89 KDM4E (0.67) MAPTTP53NPC1RAB9AALDH1A1
SCHEMBL30040616 0.87 NPC1 (0.55) MAPTTP53NPC1RAB9AALDH1A1
SCHEMBL30040826 0.86 SMN1; SMN2 (0.48) MAPTTP53NPC1RAB9AALDH1A1
SCHEMBL30040080 0.86 RAB9A (0.47) MAPTTP53NPC1RAB9AALDH1A1
SCHEMBL30040120 0.83 NR1H4 (0.57) MAPTTP53NPC1RAB9AALDH1A1
SCHEMBL30039361 0.82 SMN1; SMN2 (0.54) MAPTTP53NPC1RAB9AALDH1A1
SCHEMBL30040189 0.82 KDM4E (0.51) MAPTTP53NPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115261896-B Synthesis method of 4' -alkylamino benzyl-3-imidazo [1,2-a ] pyridine derivative 深圳职业技术学院 2024-08-30 — — CN disclosed
CN-115261896-A Synthesis method of 4' -alkylaminobenzyl-3-imidazo [1,2-a ] pyridine derivative 深圳职业技术学院 2022-11-01 — — CN disclosed
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