SCHEMBL2989577

SCHEMBL2989577

O=S(=O)(O)N1CCNCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.52
LMNA P02545 1/20 0.44
CYP3A4 P08684 1/20 0.44
GABRA1 P14867 1/20 0.44
TSHR P16473 1/20 0.44
GABRG2 P18507 1/20 0.44
NFKB1 P19838 1/20 0.44
GABRB3 P28472 1/20 0.44
GABRA5 P31644 1/20 0.44
GABRA3 P34903 1/20 0.44
GABRA2 P47869 1/20 0.44
GABRA6 Q16445 1/20 0.44
MAPT P10636 1/20 0.41
ALDH1A1 P00352 3/20 0.39
KMT2A Q03164 1/20 0.38
USP2 O75604 1/20 0.37
CA2 P00918 2/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA9 Q16790 1/20 0.37

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
Hydrochloric Acid SCHEMBL27833009 0.97 KDM4E (0.50) KDM4ELMNACYP3A4GABRA1TSHR
Ethane SCHEMBL8042958 0.95 KDM4E (0.48) KDM4ELMNACYP3A4GABRA1TSHR
Benzene SCHEMBL27821865 0.93 KDM4E (0.46) KDM4ELMNACYP3A4GABRA1TSHR
SCHEMBL10815069 0.84
Dimethylformamide SCHEMBL27563362 0.83 KDM4E (0.39) KDM4ELMNACYP3A4GABRA1TSHR
Dimethylformamide SCHEMBL27646174 0.82 KDM4E (0.38) KDM4ELMNACYP3A4GABRA1TSHR
SCHEMBL1746338 0.78
SCHEMBL7423339 0.77 KDM4E (0.80) KDM4ELMNACYP3A4GABRA1TSHR
SCHEMBL14991003 0.74 KDM4E (0.54) KDM4ELMNACYP3A4GABRA1TSHR
SCHEMBL243961 0.74 KDM4E (0.54) KDM4ELMNACYP3A4GABRA1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119699310-A Application of cellulose-based material as biological cryoprotectant 北京理工大学 2025-03-28 CN claimed
CN-117105883-A Preparation method of piperazine sulfonic acid buffer 苏州亚科科技股份有限公司 2023-11-24 CN claimed
CN-114865556-B Light high-strength MPP corrugated pipe 杭州富阳科威钢业有限公司 2023-07-18 CN claimed
CN-114634465-B Pentadienone derivative containing sulfonyl piperazine as well as preparation method and application thereof 贵州大学 2023-05-30 CN claimed
CN-110283282-B Preparation method of functional hairbrush-shaped fluorescent microspheres 上海工程技术大学 2022-08-26 CN claimed
CN-114865556-A Light high-strength MPP corrugated pipe 杭州富阳科威钢业有限公司 2022-08-05 CN claimed
CN-114634465-A Sulfonyl piperazine-containing pentadiene ketone derivative and preparation method and application thereof 贵州大学 2022-06-17 CN claimed
CN-114085199-A Chalcone derivative containing sulfonyl piperazine and preparation method and application thereof 贵州大学 2022-02-25 CN claimed
CN-110092734-A A kind of 2-(phenylmethylene) malononitrile or derivatives thereof series connection synthetic method 华侨大学 2019-08-06 CN claimed
US-7674810-B2 1,1-dioxo-1H-1Λ6-benzo[d]isothiazol-3-yl)-4-hydroxy-1,5-dihydro-pyrrol-2-one inhibitors of HCV polymerase ROCHE PALO ALTO LLC (US) 2010-03-09 US claimed
CN-101189230-A Heterocyclic antiviral compounds ROCHE PALO ALTO LLC (CH) 2008-05-28 CN claimed
EP-1879885-A1 HETEROCYCLIC ANTIVIRAL COMPOUNDS F. Hoffmann-Roche AG (CH) 2008-01-23 EP claimed
US-20060252785-A1 Heterocyclic antiviral compounds ROCHE PALO ALTO LLC 2006-11-09 US claimed
WO-2006117306-A1 HETEROCYCLIC ANTIVIRAL COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2006-11-09 WO claimed
US-6971945-B2 Multi-step polishing solution for chemical mechanical planarization ROHM AND HAAS ELECTRONIC MATERIALS CMP HOLDINGS, INC. (US) 2005-12-06 US claimed
US-20050194357-A1 MULTI-STEP POLISHING SOLUTION FOR CHEMICAL MECHANICAL PLANARIZATION ROHM AND HAAS ELECTRONIC MATERIALS CMP HOLDINGS, INC. 2005-09-08 US claimed
US-3983117-A OPTICAL BRIGHTENERS BASF AKTIENGESELLSCHAFT (DT) 1976-09-28 US claimed
US-3950340-A POLYESTERS BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1976-04-13 US claimed
CN-120923175-A Preparation method of high-durability concrete pipe pile 山东华威建筑科技有限公司 2025-11-11 CN disclosed
US-3950340-A POLYESTERS BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1976-04-13 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 (1 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-20060252785-A1 Heterocyclic antiviral compounds EIF2AK2, HAVCR2, POLR2E KDM4E 2075/4885LMNA 1768/4885CYP3A4 245/4885

“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.