SCHEMBL282035

SCHEMBL282035

CCCCCCN1C(=O)C(=O)c2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 10/20 1.00
CES1 P23141 5/20 1.00
ALDH1A1 P00352 2/20 0.97
ALDH2 P05091 2/20 0.97
ALDH3A1 P30838 2/20 0.97
BCHE P06276 2/20 0.69
PKM P14618 1/20 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
SCHEMBL28299129 1.00 CDC25A (1.00) CDC25ACES1ALDH1A1ALDH2ALDH3A1
SCHEMBL29613389 1.00 CDC25A (1.00) CDC25ACES1ALDH1A1ALDH2ALDH3A1
SCHEMBL12930216 1.00 CDC25A (1.00) CDC25ACES1ALDH1A1ALDH2ALDH3A1
SCHEMBL29821573 1.00 CDC25A (1.00) CDC25ACES1ALDH1A1ALDH2ALDH3A1
SCHEMBL3016105 1.00 CDC25A (1.00) CDC25ACES1ALDH1A1ALDH2ALDH3A1
SCHEMBL281625 0.98 ALDH1A1 (1.00) CDC25ACES1ALDH1A1ALDH2ALDH3A1
SCHEMBL3019788 0.93 ALDH1A1 (0.90) CDC25ACES1ALDH1A1ALDH2ALDH3A1
SCHEMBL25119255 0.92 CES1 (0.84) CDC25ACES1ALDH1A1ALDH2ALDH3A1
SCHEMBL25119569 0.90 CES1 (0.85) CDC25ACES1ALDH1A1ALDH2ALDH3A1
SCHEMBL30382960 0.87 CDC25A (0.77) CDC25ACES1ALDH1A1ALDH2ALDH3A1

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 60 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110903449-B Isatin arene copolymer, preparation method and application 大连理工大学 2022-09-06 CN disclosed
CN-108299137-B Selective fluorination method of isatin hydrazone compound 中南大学 2020-04-14 CN disclosed
CN-110903449-A Isatin arene copolymer, preparation method and application 大连理工大学 2020-03-24 CN disclosed
CN-109679367-A Vickery blue and preparation method thereof 浙江理工大学 2019-04-26 CN disclosed
CN-108299137-A A kind of isatin hydrazone compounds selective fluorination method 中南大学 2018-07-20 CN disclosed
US-20180200225-A1 HYDRAZONE MODULATORS OF CANNABINOID RECEPTORS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2018-07-19 US disclosed
EP-3241834-A1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS Xenon Pharmaceuticals Inc. (CA) 2017-11-08 EP disclosed
US-20170231953-A1 HYDRAZONE MODULATORS OF CANNABINOID RECEPTORS CLEVELAND CLINIC FOUND (US) 2017-08-17 US disclosed
US-9656957-B2 Hydrazone modulators of cannabinoid receptors THE CLEVELAND CLINIC FOUNDATION (US) 2017-05-23 US disclosed
US-9315484-B2 Mitochondrial aldehyde dehydrogenase-2 modulators and methods of use thereof The Board of Trustees—Leland Stanford Junior University (US) 2016-04-19 US disclosed
WO-2008112164-A2 MITOCHONDRIAL ALDEHYDE DEHYDROGENASE-2 MODULATORS AND METHODS OF USE THEREOF THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2008-09-18 WO disclosed
WO-2008060789-A2 USE OF SPIRO-OXINDOLE COMPOUNDS AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2008-05-22 WO disclosed
WO-2008046083-A2 USE OF OXINDOLE COMPOUNDS AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2008-04-17 WO disclosed
EP-1888595-A2 SPIRO-OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2008-02-20 EP disclosed
EP-1877378-A2 OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2008-01-16 EP disclosed
WO-2007132280-A1 ISATIN AND ITS DERIVATIVES FOR USE AS A MEDICAMENT Szegedi Tudományegyetem (HU) 2007-11-22 WO disclosed
US-20070105820-A1 Oxindole compounds and their uses as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2007-05-10 US disclosed
US-20060252812-A1 Spiro-oxindole compounds and their uses as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2006-11-09 US disclosed
WO-2006113864-A2 OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2006-10-26 WO disclosed
WO-2006110917-A2 SPIRO-OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2006-10-19 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070105820-A1 Oxindole compounds and their uses as therapeutic agents OPRL1, OPRK1, TRPV1 CDC25A 3151/4885CES1 4183/4885ALDH1A1 1136/4885
US-20170231953-A1 HYDRAZONE MODULATORS OF CANNABINOID RECEPTORS CNR1, CNR2, GPR18 CDC25A 2577/4885CES1 1610/4885ALDH1A1 2096/4885
US-20060252812-A1 Spiro-oxindole compounds and their uses as therapeutic agents OPRK1, OPRD1, SCN3A CDC25A 947/4885CES1 3669/4885ALDH1A1 838/4885
US-20180200225-A1 HYDRAZONE MODULATORS OF CANNABINOID RECEPTORS CNR1, CNR2, GPR18 CDC25A 2577/4885CES1 1610/4885ALDH1A1 2096/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.