SCHEMBL31026266

SCHEMBL31026266

NNC(=O)COc1cccc2ncccc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OGG1 O15527 1/20 0.65
▸ MAPT P10636 3/20 0.64
▸ KDM4E B2RXH2 4/20 0.51
▸ ALDH1A1 P00352 3/20 0.51
▸ RECQL P46063 1/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ LMNA P02545 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ MAPK1 P28482 2/20 0.46
▸ CASP1 P29466 1/20 0.46
▸ CASP3 P42574 1/20 0.46
▸ CASP7 P55210 1/20 0.46
▸ CASP8 Q14790 1/20 0.46
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ RAB9A P51151 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ PKM P14618 1/20 0.43

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
SCHEMBL4302000 0.79 OGG1 (1.00) OGG1MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL28678208 0.78 MAPT (1.00) OGG1MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL15516810 0.78 MAPT (0.65) OGG1MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL15517101 0.78 MAPT (0.65) OGG1MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL7988108 0.75 MEN1 (0.46) MAPTKDM4EALDH1A1RECQLSMN1; SMN2
SCHEMBL23412378 0.74 MAPT (0.52) MAPTKDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL28325522 0.74 OGG1 (0.89) OGG1MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL19475149 0.74 FABP5 (0.49) MAPTKDM4EALDH1A1RECQLSMN1; SMN2
SCHEMBL16572948 0.74 NSD2 (0.67) MAPTALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL6980607 0.74 FABP5 (0.46) MAPTKDM4EALDH1A1RECQLSMN1; 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-118420526-A Multifunctional compound based on tri (quinoline-5-methoxy-dihydrazide) benzene and synthesis and application thereof 西北师范大学 2024-08-02 — — CN claimed
CN-118420526-A Multifunctional compound based on tri (quinoline-5-methoxy-dihydrazide) benzene and synthesis and application thereof 西北师范大学 2024-08-02 — — CN disclosed
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