SCHEMBL6680428

SCHEMBL6680428

NCc1ccc(S(=O)(=O)c2ccc(CN)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.70
CA2 P00918 4/20 0.70
CA9 Q16790 4/20 0.70
CA12 O43570 3/20 0.70
CA4 P22748 3/20 0.70
CA6 P23280 2/20 0.70
CA5A P35218 2/20 0.70
CA7 P43166 2/20 0.70
CA14 Q9ULX7 2/20 0.70
CA5B Q9Y2D0 2/20 0.70
MAPT P10636 1/20 0.67
PSIP1 O75475 1/20 0.64
HTR6 P50406 3/20 0.57
KDM4E B2RXH2 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
CYP3A4 P08684 2/20 0.52
TSHR P16473 2/20 0.52
LMNA P02545 1/20 0.52
MPO P05164 1/20 0.52
CYP2C9 P11712 1/20 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
Hydrochloric Acid SCHEMBL3956091 0.97 CA1 (0.71) CA1CA2CA9CA12CA4
SCHEMBL158288 0.91 HTR6 (0.71) CA1CA2CA9CA12CA4
SCHEMBL151654 0.91 HTR6 (0.70) CA1CA2CA9CA12CA4
SCHEMBL157205 0.89 LOXL2 (0.67) CA1CA2CA9CA12CA4
SCHEMBL27827976 0.89 ABAT (0.67) CA1CA2CA9CA12CA4
SCHEMBL28373830 0.89 GAA (0.67) CA1CA2CA9CA12CA4
SCHEMBL5759642 0.87 LOXL2 (0.58) CA1CA2CA9CA12CA4
Hydrochloric Acid SCHEMBL159992 0.87 LOXL2 (0.64) CA1CA2CA9CA12CA4
SCHEMBL27919766 0.87 CA1 (0.55) CA1CA2CA9CA12CA4
Dapsone SCHEMBL4106701 0.84 CA2 (0.74) CA1CA2CA9CA12CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1296540-B1 DISPLAY TORAY INDUSTRIES (JP) 2019-10-16 EP disclosed
CN-105899511-B Tricyclic gyrase inhibitor 默沙东公司 2019-06-07 CN disclosed
CN-106536525-B Compound 葛兰素史密斯克莱知识产权发展有限公司 2019-05-03 CN disclosed
CN-106536525-A Compounds 葛兰素史密斯克莱知识产权发展有限公司 2017-03-22 CN disclosed
CN-105899511-A Tricyclic gyrase inhibitors 默沙东公司 2016-08-24 CN disclosed
CN-104507923-A Substituted pyrrole active agents as kinase inhibitors NERVIANO MEDICAL SCIENCES SRL 2015-04-08 CN disclosed
US-7504434-B2 Dimeric compounds and their use as anti-viral agents BIOTA SCIENTIFIC MANAGEMENT PTY LTD. (AU) 2009-03-17 US disclosed
US-20070225361-A1 DIMERIC COMPOUNDS AND THEIR USE AS ANTI-VIRAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD. 2007-09-27 US disclosed
US-7214707-B2 Dimeric compounds and their use as anti-viral agents BIOTA SCIENTIFIC MANAGEMENT PTY LTD. (AU) 2007-05-08 US disclosed
CN-1267501-C Light sensitivity resin precursor compsn. TORAY INDUSTRIES (JP) 2006-08-02 CN disclosed
EP-0878740-B1 Radiation sensitive polymer composition TORAY INDUSTRIES (JP) 2004-11-10 EP disclosed
CN-1154708-C Chemical-ray sensitive polymer composition 东丽株式会社 2004-06-23 CN disclosed
CN-1480491-A Light sensitivity resin precursor compsn. ������������ʽ���� 2004-03-10 CN disclosed
US-6696112-B2 POSITIVE-TYPE, PHOTOSENSITIVITY; FLAT PANEL DISPLAYS TORAY INDUSTRIES, INC. (JP) 2004-02-24 US disclosed
EP-1296540-A1 DISPLAY TORAY INDUSTRIES, INC. (JP) 2003-03-26 EP disclosed
US-20020162998-A1 Display TORAY INDUSTRIES, INC. (JP) 2002-11-07 US disclosed
CN-1201061-A Chemical-ray sensitive polymer composition TORAY CO LTD (JP) 1998-12-09 CN disclosed
EP-0878740-A1 Radiation sensitive polymer composition TORAY INDUSTRIES, INC. (JP) 1998-11-18 EP disclosed
EP-0495091-A4 AICA RIBOSIDE ANALOGS 1993-01-07 EP disclosed
EP-0495091-A1 AICA RIBOSIDE ANALOGS GENSIA, INC. (US) 1992-07-22 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 (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-20070225361-A1 DIMERIC COMPOUNDS AND THEIR USE AS ANTI-VIRAL AGENTS EIF2AK2, IRF3, SARS1 CA1 2901/4885CA2 1733/4885CA9 2397/4885

“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.