SCHEMBL1744280

SCHEMBL1744280

COC(=O)c1ccc(S)c(N)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.66
ALDH1A1 P00352 9/20 0.66
MAPT P10636 9/20 0.66
HPGD P15428 7/20 0.66
GAA P10253 4/20 0.66
HSD17B10 Q99714 4/20 0.66
GLA P06280 1/20 0.66
CASP1 P29466 1/20 0.66
CASP7 P55210 1/20 0.66
ATM Q13315 1/20 0.66
USP2 O75604 1/20 0.55
NPC1 O15118 3/20 0.53
NPSR1 Q6W5P4 2/20 0.53
RAB9A P51151 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
CA1 P00915 3/20 0.52
CA2 P00918 3/20 0.52
CA12 O43570 2/20 0.52
CA7 P43166 2/20 0.52
CA9 Q16790 2/20 0.52

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
SCHEMBL6524792 0.98 KDM4E (0.64) KDM4EALDH1A1MAPTHPGDGAA
SCHEMBL6515756 0.98 KDM4E (0.64) KDM4EALDH1A1MAPTHPGDGAA
SCHEMBL6515761 0.98 KDM4E (0.64) KDM4EALDH1A1MAPTHPGDGAA
Hydrochloric Acid SCHEMBL6512620 0.98 KDM4E (0.64) KDM4EALDH1A1MAPTHPGDGAA
SCHEMBL24820015 0.85 KDM4E (0.61) KDM4EALDH1A1MAPTHPGDGAA
Hydrochloric Acid SCHEMBL6752001 0.84 KDM4E (0.59) KDM4EALDH1A1MAPTHPGDGAA
SCHEMBL192100 0.82 KDM4E (0.72) KDM4EALDH1A1MAPTHPGDGAA
SCHEMBL21383063 0.82 CA1 (0.57) KDM4EALDH1A1MAPTHPGDGAA
SCHEMBL29375113 0.82 KDM4E (0.72) KDM4EALDH1A1MAPTHPGDGAA
Hydrochloric Acid SCHEMBL1223871 0.81 KDM4E (0.70) KDM4EALDH1A1MAPTHPGDGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119569664-B Thiophenol compound and preparation method and application thereof 山东师范大学 2025-04-29 CN claimed
CN-119569664-A Thiophenol compound and preparation method and application thereof 山东师范大学 2025-03-07 CN claimed
CN-119569664-B Thiophenol compound and preparation method and application thereof 山东师范大学 2025-04-29 CN disclosed
CN-119569664-A Thiophenol compound and preparation method and application thereof 山东师范大学 2025-03-07 CN disclosed
CN-117858865-A CBL-B modulators and uses thereof 林伯士克莱奥公司 2024-04-09 CN disclosed
CN-110066389-B Ionic monomer containing benzo-heterocycle sulfonate structure, flame-retardant anti-dripping ionomer using ionic monomer, and preparation methods and applications of ionic monomer and ionomer 四川大学 2022-03-15 CN disclosed
EP-3292893-B1 GOLF BALL SUMITOMO RUBBER IND (JP) 2021-06-09 EP disclosed
EP-2656882-B1 Golf ball SUMITOMO RUBBER IND (JP) 2021-06-09 EP disclosed
EP-3156441-B1 GOLF BALL SUMITOMO RUBBER IND (JP) 2020-11-25 EP disclosed
EP-3329971-B1 GOLF BALL SUMITOMO RUBBER IND (JP) 2020-11-18 EP disclosed
EP-2666521-B1 Golf ball SUMITOMO RUBBER IND (JP) 2020-09-02 EP disclosed
US-20070066588-A1 Benzothiazole cyclobutyl amine derivatives ABBVIE INC. 2007-03-22 US disclosed
US-6919393-B2 Solid golf ball SRI SPORTS LIMITED (JP) 2005-07-19 US disclosed
US-20050009054-A1 Compounds having a fused, bicyclic moiety for binding to the minor groove of dsDNA PHARMACIA CORPORATION 2005-01-13 US disclosed
WO-2004099131-A2 COMPOUNDS HAVING A FUSED, BICYCLIC MOIETY FOR BINDING TO THE MINOR GROOVE OF DSDNA PHARMACIA CORPORATION (US) 2004-11-18 WO disclosed
US-20040092737-A1 Benzopiperidine derivatives EISAI CO., LTD. 2004-05-13 US disclosed
US-20030144425-A1 Solid golf ball SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2003-07-31 US disclosed
US-20030144427-A1 Solid golf ball SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2003-07-31 US disclosed
US-6518423-B1 These compounds are useful as drugs efficacious in the prevention and treatment of these various inflammatory diseases and immunologic diseases, such as rheumatoid arthritis, atopic dermatitis, psoriasis, asthma, and EISAI CO., LTD. (JP) 2003-02-11 US disclosed
EP-0934941-A1 BENZOPIPERIDINE DERIVATIVES Eisai Co., Ltd. (JP) 1999-08-11 EP 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-20040092737-A1 Benzopiperidine derivatives HLA-DRB1, HRH1, HRH2 KDM4E 1573/4885ALDH1A1 145/4885MAPT 1257/4885
US-20050009054-A1 Compounds having a fused, bicyclic moiety for binding to the minor groove of dsDNA PCNA, POLM, PBRM1 KDM4E 3756/4885ALDH1A1 4554/4885MAPT 320/4885
US-20070066588-A1 Benzothiazole cyclobutyl amine derivatives HRH2, HRH4, HRH1 KDM4E 3229/4885ALDH1A1 926/4885MAPT 1069/4885

“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.