SCHEMBL910072

SCHEMBL910072

Cc1cccc(Cl)c1[C]=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
PKM P14618 1/20 0.36
CYP3A4 P08684 2/20 0.35
CYP1A2 P05177 3/20 0.35
CYP2A6 P11509 2/20 0.35
CD44 P16070 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
GAA P10253 1/20 0.34
HDAC4 P56524 1/20 0.34
PBRM1 Q86U86 1/20 0.34
GRIA1 P42261 1/20 0.34
CACNG8 Q8WXS5 1/20 0.34
TYK2 P29597 1/20 0.34
TSHR P16473 2/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33

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
SCHEMBL96213 0.83 CYP1A2 (0.43) ALDH1A1CYP1A2CYP2A6MEN1KMT2A
SCHEMBL476988 0.83 CYP1A2 (0.43) ALDH1A1CYP3A4CYP1A2CYP2A6CD44
SCHEMBL6149952 0.77 CD44 (0.50) ALDH1A1CYP3A4CYP1A2CYP2A6CD44
SCHEMBL103444 0.77 CYP1A2 (0.50) ALDH1A1CYP3A4CYP1A2MEN1KMT2A
SCHEMBL6149211 0.77 TSHR (0.48) ALDH1A1CYP3A4CYP1A2CYP2A6MEN1
SCHEMBL102469 0.74 CYP1A2 (0.36) ALDH1A1CYP1A2CYP2A6MEN1KMT2A
SCHEMBL1698298 0.74 TSHR (0.39) ALDH1A1CYP3A4CYP1A2CYP2A6CD44
SCHEMBL571847 0.73 TRPA1 (0.50) ALDH1A1CYP3A4CYP1A2CYP2A6TDP1
SCHEMBL21201383 0.73 ACHE (0.48) ALDH1A1PKMCYP3A4CYP1A2CYP2A6
SCHEMBL909850 0.73 LMNA (0.38) ALDH1A1CYP3A4CYP1A2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108699008-B Sulfonamide derivatives and pharmaceutical compositions containing the same EA制药株式会社 2021-10-08 CN disclosed
EP-3412660-B9 SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME EA PHARMA CO LTD (JP) 2021-04-14 EP disclosed
EP-3412660-B1 SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME EA PHARMA CO LTD (JP) 2020-11-18 EP disclosed
US-10562898-B2 Substituted benzenesulfonamides as inhibitors of alpha-4 beta-7 integrin activity EA PHARMA CO., LTD. (JP) 2020-02-18 US disclosed
US-20190040059-A1 SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME EA PHARMA CO., LTD. (JP) 2019-02-07 US disclosed
EP-3412660-A1 SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME EA Pharma Co., Ltd. (JP) 2018-12-12 EP disclosed
WO-2015008234-A1 BICYCLIC HETEROCYCLIC COMPOUNDS AS ROR GAMMA MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2015-01-22 WO disclosed
US-8426588-B2 Phenylalanine derivatives AJINOMOTO CO, INC. (JP) 2013-04-23 US disclosed
US-20120253041-A1 NEW PHENYLALANINE DERIVATIVES AJINOMOTO CO., INC. (JP) 2012-10-04 US disclosed
US-8222405-B2 Phenylalanine derivatives AJINOMOTO CO., INC. (JP) 2012-07-17 US disclosed
EP-0126635-B1 NOVEL OXINDOLE DERIVATIVE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-12-18 EP disclosed
US-4737501-A Substituted piperazinyl oxindol compounds and cardiotonic compositions containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-04-12 US disclosed
US-4694017-A 2-amido 3(oxindol-3-yl)propionic acids having antiulcer activity OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1987-09-15 US disclosed
EP-0168003-A1 Oxindol compounds, compositions containing same and processes for preparing same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-01-15 EP disclosed
US-4514401-A CARDIOTONICS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1985-04-30 US disclosed
US-4487772-A CARDIOTONIC AGENTS OTSUKA PHARMACEUTICAL CO. LTD. (JP) 1984-12-11 US disclosed
EP-0126635-A2 Novel oxindole derivative OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-11-28 EP disclosed
US-4468402-A Carbostyril derivatives, process for producing the same and cardiotonic compositions containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-08-28 US disclosed
US-4454130-A CARDIOTONIC, HYPOTENSIVE AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-06-12 US disclosed
US-4415572-A CARDIOTONIC AND INOTROPIC AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1983-11-15 US 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 (3 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-10562898-B2 Substituted benzenesulfonamides as inhibitors of alpha-4 beta-7 integrin activity ITGB4, ITGB7, ITGA4 ALDH1A1 404/4885PKM 4493/4885CYP3A4 684/4885
US-20190040059-A1 SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME ITGB4, ITGB5, ITGA4 ALDH1A1 642/4885PKM 3153/4885CYP3A4 392/4885
US-20120253041-A1 NEW PHENYLALANINE DERIVATIVES ITGB4, ITGA4, ITGAV ALDH1A1 1310/4885PKM 1057/4885CYP3A4 653/4885

“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.