SCHEMBL30040616

SCHEMBL30040616

COc1ccc(-c2nc3ccccn3c2Cc2ccc(N(C)C)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 5/20 0.55
▸ RAB9A P51151 5/20 0.55
▸ SMN1; SMN2 Q16637 6/20 0.55
▸ KDM4E B2RXH2 5/20 0.55
▸ ALDH1A1 P00352 4/20 0.55
▸ TUBB4A P04350 1/20 0.51
▸ TUBB P07437 1/20 0.51
▸ TUBA3C P0DPH7 1/20 0.51
▸ TUBA1B P68363 1/20 0.51
▸ TUBA4A P68366 1/20 0.51
▸ TUBB4B P68371 1/20 0.51
▸ TUBB3 Q13509 1/20 0.51
▸ TUBB2A Q13885 1/20 0.51
▸ TUBB8 Q3ZCM7 1/20 0.51
▸ TUBA3E Q6PEY2 1/20 0.51
▸ TUBA1A Q71U36 1/20 0.51
▸ TUBA1C Q9BQE3 1/20 0.51
▸ TUBB6 Q9BUF5 1/20 0.51
▸ TUBB2B Q9BVA1 1/20 0.51
▸ TUBB1 Q9H4B7 1/20 0.51

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 0.88 SMN1; SMN2 (0.52) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL30039938 0.88 KCNK3 (0.51) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL30038776 0.87 MAPT (0.61) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL30040119 0.86 KDM4E (0.67) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL30039601 0.86 MAPT (0.59) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL30039276 0.86 ALDH1A1 (0.51) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL30040080 0.85 RAB9A (0.47) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL30040826 0.83 SMN1; SMN2 (0.48) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL30040108 0.83 AKT1 (0.45) RAB9ASMN1; SMN2KDM4EALDH1A1RAD51
SCHEMBL30040189 0.79 KDM4E (0.51) NPC1RAB9ASMN1; SMN2KDM4EMAPT

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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