SCHEMBL5594225

SCHEMBL5594225

O=C1c2cccc3cccc(c23)C(=O)N1Cc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 1.00
▸ KDM4E B2RXH2 6/20 0.71
▸ MAPT P10636 3/20 0.71
▸ ALDH1A1 P00352 3/20 0.71
▸ GAA P10253 2/20 0.71
▸ RAB9A P51151 1/20 0.71
▸ SMN1; SMN2 Q16637 1/20 0.71
▸ UBE2N P61088 3/20 0.68
▸ ATM Q13315 2/20 0.68
▸ CYP1B1 Q16678 3/20 0.67
▸ CA12 O43570 1/20 0.66
▸ CA1 P00915 1/20 0.66
▸ CA2 P00918 1/20 0.66
▸ CA9 Q16790 1/20 0.66
▸ CLTC Q00610 1/20 0.64
▸ CASP3 P42574 1/20 0.64
▸ MEN1 O00255 2/20 0.63
▸ KMT2A Q03164 2/20 0.63
▸ LMNA P02545 2/20 0.63
▸ RECQL P46063 2/20 0.63

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
SCHEMBL9720966 0.88 NPSR1 (0.79) NPSR1KDM4EMAPTALDH1A1GAA
SCHEMBL27169540 0.85 NPSR1 (0.73) NPSR1KDM4EMAPTALDH1A1GAA
SCHEMBL12431370 0.85 NPSR1 (0.73) NPSR1MAPTALDH1A1CYP1B1CA12
SCHEMBL28277900 0.85 NPSR1 (0.73) NPSR1KDM4EMAPTALDH1A1GAA
SCHEMBL28737144 0.85 UBE2N (0.81) NPSR1KDM4EMAPTALDH1A1GAA
SCHEMBL30472950 0.85 CASP3 (0.85) NPSR1KDM4EMAPTALDH1A1CYP1B1
SCHEMBL326305 0.85 CASP3 (0.85) NPSR1KDM4EMAPTALDH1A1CYP1B1
SCHEMBL8153395 0.84 NPSR1 (0.72) NPSR1KDM4EMAPTALDH1A1GAA
SCHEMBL28284669 0.83 ALDH1A1 (1.00) NPSR1KDM4EMAPTALDH1A1GAA
SCHEMBL28737148 0.82 UBE2N (0.82) NPSR1KDM4EMAPTALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112143253-B Cationic fluorescent dye based on benzyl naphthalimide structure and preparation and application thereof 盐城东吴化工有限公司 2022-07-05 — — CN claimed
CN-112143253-A Cationic fluorescent dye based on benzyl naphthalimide structure and preparation and application thereof 盐城东吴化工有限公司 2020-12-29 — — CN claimed
CN-113717104-B Preparation and application of leveling cationic fluorescent dye containing long carbon chain 盐城东吴化工有限公司 2024-01-02 — — CN disclosed
CN-113831286-B Gemini type naphthalimide cationic fluorescent dye and preparation method thereof 东华大学 2023-02-28 — — CN disclosed
CN-112143253-B Cationic fluorescent dye based on benzyl naphthalimide structure and preparation and application thereof 盐城东吴化工有限公司 2022-07-05 — — CN disclosed
CN-112143253-B Cationic fluorescent dye based on benzyl naphthalimide structure and preparation and application thereof 盐城东吴化工有限公司 2022-07-05 — — CN disclosed
CN-112143253-B Cationic fluorescent dye based on benzyl naphthalimide structure and preparation and application thereof 盐城东吴化工有限公司 2022-07-05 — — CN disclosed
CN-109928927-B Application of two-photon fluorescent probe for detecting cytochrome oxidase CYP3A4 大连医科大学 2022-05-13 — — CN disclosed
CN-113831286-A Gemini naphthalimide cationic fluorescent dye and preparation method thereof 东华大学 2021-12-24 — — CN disclosed
CN-113717104-A Preparation and application of leveling cationic fluorescent dye containing long carbon chain 盐城东吴化工有限公司 2021-11-30 — — CN disclosed
CN-112143253-A Cationic fluorescent dye based on benzyl naphthalimide structure and preparation and application thereof 盐城东吴化工有限公司 2020-12-29 — — CN disclosed
CN-112143253-A Cationic fluorescent dye based on benzyl naphthalimide structure and preparation and application thereof 盐城东吴化工有限公司 2020-12-29 — — CN disclosed
CN-112143253-A Cationic fluorescent dye based on benzyl naphthalimide structure and preparation and application thereof 盐城东吴化工有限公司 2020-12-29 — — CN disclosed
CN-110272388-A 4- dithiocarbonic acid piperazine -3- nitro -1,8- naphthalimide derivative and its synthetic method and application 桂林医学院 2019-09-24 — — CN disclosed
CN-109928927-A Application of two-photon type fluorescent probe for detecting cytochrome oxidase CYP3A4 大连医科大学 2019-06-25 — — CN disclosed
WO-2007124543-A1 PROFLUORESCENT NITROXIDE COMPOUNDS QUEENSLAND UNIVERSITY OF TECHNOLOGY (AU) 2007-11-08 — — WO disclosed
WO-2007124543-A1 PROFLUORESCENT NITROXIDE COMPOUNDS QUEENSLAND UNIVERSITY OF TECHNOLOGY (AU) 2007-11-08 — — WO disclosed
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