SCHEMBL601074

SCHEMBL601074

CCOCCCOc1cc[nH]c(=S)c1C

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
APOBEC3G Q9HC16 1/20 0.33
NCF1 P14598 1/20 0.31
MAPT P10636 3/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
RAB9A P51151 1/20 0.31
ATM Q13315 1/20 0.31
HPGD P15428 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
GAA P10253 2/20 0.30
ALDH1A1 P00352 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL601317 0.84 MAPT (0.36) MAPTGAAALDH1A1
SCHEMBL600119 0.83 MAPT (0.37) MAPTRAB9AATMHPGDGAA
SCHEMBL601778 0.81 LMNA (0.33) NCF1MAPTL3MBTL1HPGDTDP1
SCHEMBL600143 0.78 ALDH1A1 (0.34) MAPTL3MBTL1RAB9AHPGDTDP1
SCHEMBL600956 0.74 MEN1 (0.33) MAPT
SCHEMBL600960 0.65 GPR84 (0.39) MAPTHPGDALDH1A1KDM4E
SCHEMBL599561 0.64 KDM4E (0.43) MAPTATMHPGDGAAALDH1A1
SCHEMBL9386188 0.62 ALDH1A1 (0.35) NCF1MAPTL3MBTL1TDP1GAA
SCHEMBL1685766 0.62 L3MBTL1 (0.58) MAPTL3MBTL1RAB9AHPGDTDP1
SCHEMBL20234907 0.61 DRD2 (0.55) L3MBTL1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2420500-A1 PYRIDINE THIO DERIVATIVE, AND PHARMACEUTICAL COMPOSITION WHICH CONTAINS SAME AND HAS ANTI-HELICOBACTER PYLORI ACTION aRigen Pharmaceuticals, Inc. (JP) 2012-02-22 EP disclosed
US-20120041030-A1 PYRIDINE THIO DERIVATIVE, AND PHARMACEUTICAL COMPOSITION WHICH CONTAINS SAME AND HAS ANTI-HELICOBACTER PYLORI ACTION LINK GENOMICS, INC. (JP) 2012-02-16 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-20120041030-A1 PYRIDINE THIO DERIVATIVE, AND PHARMACEUTICAL COMPOSITION WHICH CONTAINS SAME AND HAS ANTI-HELICOBACTER PYLORI ACTION TPMT, TST, PTPN11 APOBEC3G 4790/4885NCF1 2067/4885MAPT 4487/4885

“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.