SCHEMBL16125136

SCHEMBL16125136

CN(C)S(=O)(=O)n1ccnc1CBr

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
HTT P42858 1/20 0.37
FGFR1 P11362 8/20 0.36
FGFR2 P21802 8/20 0.36
FGFR4 P22455 8/20 0.36
FGFR3 P22607 8/20 0.36
KDR P35968 7/20 0.36
TSHR P16473 4/20 0.36
MAPK1 P28482 1/20 0.34
ALDH1A1 P00352 1/20 0.33
SORD Q00796 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
SCHEMBL8142536 0.84 TSHR (0.48) KDM4EGAAHTTFGFR1FGFR2
SCHEMBL20309635 0.83 KDM4E (0.37) KDM4EGAAHTTFGFR1FGFR2
SCHEMBL4200809 0.83 KDM4E (0.37) KDM4EGAAHTTFGFR1FGFR2
SCHEMBL4215152 0.83 SORD (0.42) KDM4EGAAHTTFGFR1FGFR2
SCHEMBL8142567 0.81 SMN1; SMN2 (0.47) KDM4EGAAHTTFGFR1FGFR2
SCHEMBL2126277 0.81 KDM4E (0.36) KDM4EGAAHTTFGFR1FGFR2
SCHEMBL14334526 0.81 FGFR1 (0.40) KDM4EGAAHTTFGFR1FGFR2
SCHEMBL4068129 0.80 KDM4E (0.36) KDM4EGAAHTTFGFR1FGFR2
SCHEMBL13358949 0.79 FGFR1 (0.37) KDM4EGAAHTTFGFR1FGFR2
SCHEMBL8135275 0.79 SMN1; SMN2 (0.40) KDM4EGAAHTTFGFR1FGFR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2861584-B1 Pyridopyrazine and naphthyridine derivatives for the treatment of cancer ASTEX THERAPEUTICS LTD (GB) 2020-02-19 EP disclosed
US-10004733-B2 2018-06-26 US disclosed
US-10004733-B2 2018-06-26 US disclosed
US-9737544-B2 Compounds ASTEX THERAPEUTICS LIMITED (GB) 2017-08-22 US disclosed
US-9737544-B2 Compounds ASTEX THERAPEUTICS LIMITED (GB) 2017-08-22 US disclosed
US-20160235744-A1 SUBSTITUTED PYRIDO[2,3-b]PYRAZINES AS FGFR KINASE INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2016-08-18 US disclosed
US-20160235744-A1 SUBSTITUTED PYRIDO[2,3-b]PYRAZINES AS FGFR KINASE INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2016-08-18 US disclosed
US-20160213677-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2016-07-28 US disclosed
US-20160213677-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2016-07-28 US disclosed
US-9309242-B2 Substituted pyrido[2,3-b]pyrazines as FGFR kinase inhibitors ASTEX THERAPEUTICS LTD (GB) 2016-04-12 US disclosed
US-9309242-B2 Substituted pyrido[2,3-b]pyrazines as FGFR kinase inhibitors ASTEX THERAPEUTICS LTD (GB) 2016-04-12 US disclosed
US-9303030-B2 Compounds ASTEX THERAPEUTICS LIMITED (GB) 2016-04-05 US disclosed
US-9303030-B2 Compounds ASTEX THERAPEUTICS LIMITED (GB) 2016-04-05 US disclosed
US-20150239883-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2015-08-27 US disclosed
US-20150239883-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2015-08-27 US disclosed
US-20140288053-A1 ANTICANCER PYRIDOPYRAZINES VIA THE INHIBITION OF FGFR KINASES ASTEX THERAPEUTICS LIMITED (GB) 2014-09-25 US disclosed
US-20140288053-A1 ANTICANCER PYRIDOPYRAZINES VIA THE INHIBITION OF FGFR KINASES ASTEX THERAPEUTICS LIMITED (GB) 2014-09-25 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 (5 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-10004733-B2 SDHB, SDHA, NDUFS5 KDM4E 3331/4885GAA 1015/4885HTT 1719/4885
US-20140288053-A1 ANTICANCER PYRIDOPYRAZINES VIA THE INHIBITION OF FGFR KINASES FGFR1, FGFR2, FGFR4 KDM4E 939/4885GAA 1855/4885HTT 1702/4885
US-20150239883-A1 NEW COMPOUNDS NTPCR, MT-ND5, NQO1 KDM4E 1881/4885GAA 1425/4885HTT 569/4885
US-20160235744-A1 SUBSTITUTED PYRIDO[2,3-b]PYRAZINES AS FGFR KINASE INHIBITORS FGFR1, FGFR2, FGFR3 KDM4E 987/4885GAA 2712/4885HTT 2656/4885
US-20160213677-A1 NEW COMPOUNDS NTPCR, MT-ND5, NQO1 KDM4E 1881/4885GAA 1425/4885HTT 569/4885

“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.