SCHEMBL30040900

SCHEMBL30040900

Cc1cccc2nc(-c3ccccc3)c(Cc3ccc(N(C)C)cc3)n12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 3/20 0.44
▸ PKM P14618 1/20 0.44
▸ PKLR P30613 1/20 0.44
▸ GAA P10253 5/20 0.44
▸ MAPT P10636 3/20 0.44
▸ AKT1 P31749 1/20 0.40
▸ AKT2 P31751 1/20 0.40
▸ ADK P55263 3/20 0.39
▸ SMN1; SMN2 Q16637 5/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ ALDH1A1 P00352 4/20 0.38
▸ MAPK1 P28482 3/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ NOX1 Q9Y5S8 1/20 0.38
▸ RAB9A P51151 2/20 0.37
▸ F2 P00734 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ POLB P06746 1/20 0.35

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 0.80 SMN1; SMN2 (0.52) TP53PKMGAAMAPTSMN1; SMN2
SCHEMBL30040120 0.77 NR1H4 (0.57) TP53MAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL30039361 0.76 SMN1; SMN2 (0.54) TP53PKMPKLRGAAMAPT
SCHEMBL30038776 0.75 MAPT (0.61) TP53PKMGAAMAPTSMN1; SMN2
SCHEMBL30040911 0.73 KDM4E (0.45) MAPTAKT1AKT2ADKSMN1; SMN2
SCHEMBL30040895 0.72 GAA (0.52) TP53GAAMAPTAKT1AKT2
SCHEMBL30040119 0.71 KDM4E (0.67) TP53PKMGAAMAPTSMN1; SMN2
SCHEMBL30039276 0.71 ALDH1A1 (0.51) TP53PKMGAAMAPTSMN1; SMN2
SCHEMBL30039601 0.71 MAPT (0.59) TP53PKMGAAMAPTSMN1; SMN2
SCHEMBL30040189 0.71 KDM4E (0.51) TP53GAAMAPTSMN1; SMN2KDM4E

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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