SCHEMBL600143

SCHEMBL600143

COCCOCCOc1cc[nH]c(=S)c1C

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.34
MAPT P10636 4/20 0.33
L3MBTL1 Q9Y468 4/20 0.33
MAPK1 P28482 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 3/20 0.32
TDP1 Q9NUW8 1/20 0.32
KDM4E B2RXH2 2/20 0.32
RECQL P46063 1/20 0.32
HPGD P15428 1/20 0.32
POLB P06746 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL600956 0.82 MEN1 (0.33) MAPTMAPK1MEN1KMT2A
SCHEMBL601506 0.81 P2RY12 (0.34) ALDH1A1MAPTL3MBTL1MAPK1MEN1
SCHEMBL601317 0.78 MAPT (0.36) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL18090997 0.70 SMN1; SMN2 (0.57) ALDH1A1MAPTL3MBTL1MAPK1MEN1
SCHEMBL5349206 0.68 L3MBTL1 (0.61) ALDH1A1MAPTL3MBTL1KMT2ALMNA
SCHEMBL4101620 0.68 L3MBTL1 (0.61) ALDH1A1MAPTL3MBTL1KMT2ALMNA
SCHEMBL601236 0.67 DAO (0.34) ALDH1A1MAPTL3MBTL1MAPK1MEN1
SCHEMBL21169162 0.66 ALDH1A1 (0.50) ALDH1A1MAPTL3MBTL1KMT2ALMNA
SCHEMBL7977434 0.66 L3MBTL1 (0.43) ALDH1A1MAPTL3MBTL1LMNASMN1; SMN2
SCHEMBL7975336 0.66 ALDH1A1 (0.44) ALDH1A1MAPTL3MBTL1MEN1KMT2A

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 ALDH1A1 1770/4885MAPT 4487/4885L3MBTL1 3925/4885

“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.