SCHEMBL201356

SCHEMBL201356

CS(=O)(=O)c1ccc(CN)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 1/20 0.65
CA2 P00918 5/20 0.64
CA1 P00915 4/20 0.64
CA9 Q16790 4/20 0.64
CA12 O43570 3/20 0.64
CA4 P22748 3/20 0.64
CA6 P23280 2/20 0.64
CA5A P35218 2/20 0.64
CA7 P43166 2/20 0.64
CA14 Q9ULX7 2/20 0.64
CA5B Q9Y2D0 2/20 0.64
MAPT P10636 1/20 0.61
KDM4E B2RXH2 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
LOXL2 Q9Y4K0 5/20 0.50
LOX P28300 2/20 0.50
ENPP2 Q13822 2/20 0.50
HRH3 Q9Y5N1 1/20 0.46
PTGS2 P35354 1/20 0.44
ABAT P80404 1/20 0.42

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 SCHEMBL353075 0.98 CA2 (0.65) PSIP1CA2CA1CA9CA12
SCHEMBL4183608 0.94 PSIP1 (0.59) PSIP1CA2CA1CA9CA12
Hydrochloric Acid SCHEMBL4199854 0.92 CA1 (0.59) PSIP1CA2CA1CA9CA12
SCHEMBL2680954 0.90 PSIP1 (0.55) PSIP1CA2CA1CA9CA12
SCHEMBL28476756 0.88 ST14 (0.57) PSIP1CA2CA1CA9CA12
SCHEMBL2680953 0.88 PSIP1 (0.53) PSIP1CA2CA1CA9CA12
SCHEMBL1145886 0.84 GHSR (0.60) CA2CA1CA9CA12
SCHEMBL1251844 0.82 CA2 (0.67) PSIP1CA2CA1CA9CA12
SCHEMBL17168916 0.82 PSIP1 (0.61) PSIP1CA2CA1CA9CA12
SCHEMBL28332047 0.81 PTGS2 (0.54) PSIP1CA2CA1CA9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110963967-B Preparation method of 2-methyl-4-aminoquinoline 武汉智顿科技发展有限公司 2021-02-12 CN claimed
CN-110963967-A Preparation method of 2-methyl-4-aminoquinoline 武汉智顿科技发展有限公司 2020-04-07 CN claimed
EP-3233833-B1 NOVEL COMPOUNDS CHIESI FARM SPA (IT) 2019-02-20 EP claimed
EP-1773768-B1 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS INC (US) 2018-08-22 EP claimed
EP-1363906-B1 HETEROCYCLIC INHIBITORS OF ERK2 AND USES THEREOF VERTEX PHARMA (US) 2015-07-15 EP claimed
US-8729089-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2014-05-20 US claimed
EP-2228065-B1 Heterocyclo inhibitors of potassium channel function BRISTOL MYERS SQUIBB CO (US) 2012-12-26 EP claimed
EP-1732896-B1 SUBSTITUTED PYRIDONES AS INHIBITORS OF POLY(ADP-RIBOSE) POLYMERASE (PARP) AVENTIS PHARMA INC (US) 2012-12-12 EP claimed
CN-102762556-A Imidazo [1,2-a ] pyridine compounds and synthesis and use methods thereof UNIV NOTRE DAME DU LAC 2012-10-31 CN claimed
EP-2496578-A2 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS, SYNTHESIS THEREOF, AND METHODS OF USING SAME University of Notre Dame du Lac (US) 2012-09-12 EP claimed
WO-2008077651-A1 PYRIDO(3,2-D)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-03 WO claimed
US-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 US claimed
US-20080045498-A1 POLYCYCLIC VIRAL INHIBITORS GENELABS TECHNOLOGIES, INC. 2008-02-21 US claimed
WO-2008011521-A2 POLYCYCLIC VIRAL INHIBITORS GENELABS TECHNOLOGIES, INC. (US) 2008-01-24 WO claimed
WO-2008008907-A2 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. (US) 2008-01-17 WO claimed
WO-2008008912-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. (US) 2008-01-17 WO claimed
CN-101034260-A Photosensitive resin composition DONGJIN SEMICHEM CO LTD (KR) 2007-09-12 CN claimed
US-20060211698-A1 Bicyclic heteroaryl derivatives for treating viruses GENELABS, INC. 2006-09-21 US claimed
EP-1567151-B1 3-(2-HYDROXY-PHENYL)-1H-PYRAZOLE-4-CARBOXYLIC ACID AMIDE DERIVATIVES AS HSP90 INHIBITORS FOR THE TREATMENT OF CANCER VERNALIS CAMBRIDGE LTD (GB) 2006-03-15 EP claimed
US-6693200-B2 IP RECEPTOR ANTAGONISTS; ANTIINFLAMMATORIES AND ANALGESICS SYNTEX (U.S.A.) LLC 2004-02-17 US claimed

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-20080045498-A1 POLYCYCLIC VIRAL INHIBITORS EIF2AK2, ZC3HAV1, MAVS PSIP1 1550/4885CA2 3882/4885CA1 4504/4885
US-20060211698-A1 Bicyclic heteroaryl derivatives for treating viruses HAVCR2, ZC3HAV1, SARS1 PSIP1 3395/4885CA2 4677/4885CA1 4734/4885
US-20080051384-A1 ANTIVIRAL AGENTS EIF2AK2, MAVS, ZC3HAV1 PSIP1 1813/4885CA2 4389/4885CA1 4754/4885

“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.