SCHEMBL17309802

SCHEMBL17309802

CCOC(=O)c1sc(-c2ccc(F)c([N+](=O)[O-])c2)nc1C

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 4/20 0.56
DBF4 Q9UBU7 4/20 0.56
TRPM8 Q7Z2W7 6/20 0.51
PTPN11 Q06124 1/20 0.48
MAPT P10636 3/20 0.48
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.47
RAB9A P51151 1/20 0.47
THRA P10827 2/20 0.46
THRB P10828 2/20 0.46
DHODH Q02127 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
HSP90AA1 P07900 1/20 0.46
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46

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
SCHEMBL460614 0.88 CDC7 (0.57) CDC7DBF4TRPM8PTPN11MAPT
SCHEMBL8867203 0.87 CDC7 (0.56) CDC7DBF4TRPM8PTPN11MAPT
SCHEMBL8868127 0.85 CDC7 (0.54) CDC7DBF4TRPM8PTPN11MAPT
SCHEMBL17309789 0.84 CDC7 (0.53) CDC7DBF4TRPM8PTPN11MAPT
SCHEMBL8866949 0.83 CDC7 (0.52) CDC7DBF4TRPM8PTPN11MAPT
SCHEMBL8868119 0.83 CDC7 (0.54) CDC7DBF4TRPM8PTPN11MAPT
SCHEMBL17309825 0.82 CDC7 (0.50) CDC7DBF4TRPM8PTPN11MAPT
SCHEMBL8868456 0.82 CDC7 (0.50) CDC7DBF4TRPM8PTPN11MAPT
SCHEMBL469541 0.82 XDH (0.54) CDC7DBF4LMNA
SCHEMBL8867675 0.82 CDC7 (0.50) CDC7DBF4TRPM8PTPN11MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2952513-B1 AZOLE BENZENE DERIVATIVE TEIJIN PHARMA LTD (JP) 2019-07-10 EP disclosed
US-10301300-B2 Xanthine oxidase inhibitor TEIJIN LIMITED (JP) 2019-05-28 US disclosed
US-20180244665-A1 XANTHINE OXIDASE INHIBITOR TEIJIN PHARMA LIMITED (JP) 2018-08-30 US disclosed
US-20170217948-A1 XANTHINE OXIDASE INHIBITOR TEIJIN PHARMA LIMITED (JP) 2017-08-03 US disclosed
US-9388174-B2 Azole benzene derivative TEIJIN PHARMA LIMITED (JP) 2016-07-12 US disclosed
US-20150376174-A1 AZOLE BENZENE DERIVATIVE TEIJIN PHARMA LIMITED (JP) 2015-12-31 US disclosed
EP-2952513-A1 AZOLE BENZENE DERIVATIVE Teijin Pharma Limited (JP) 2015-12-09 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 (4 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-10301300-B2 Xanthine oxidase inhibitor XDH, PNPO, PCSK9 CDC7 4454/4885DBF4 3869/4885TRPM8 2847/4885
US-20180244665-A1 XANTHINE OXIDASE INHIBITOR XDH, PNPO, PCSK9 CDC7 4454/4885DBF4 3869/4885TRPM8 2847/4885
US-20150376174-A1 AZOLE BENZENE DERIVATIVE XDH, NLRP3, ALPI CDC7 2473/4885DBF4 946/4885TRPM8 2085/4885
US-20170217948-A1 XANTHINE OXIDASE INHIBITOR XDH, PNPO, PCSK9 CDC7 4454/4885DBF4 3869/4885TRPM8 2847/4885

“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.