SCHEMBL5239145

SCHEMBL5239145

CC(=C(C#N)C(N)=S)N(C)C

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.39
ALDH1A1 P00352 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 1/20 0.34
TSHR P16473 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
SCHEMBL5239135 1.00 HPGD (0.39) HPGDALDH1A1L3MBTL1MAPTTSHR
SCHEMBL5239138 1.00 HPGD (0.39) HPGDALDH1A1L3MBTL1MAPTTSHR
SCHEMBL11604586 0.79 ALDH1A1 (0.36) HPGDALDH1A1MAPT
SCHEMBL11604584 0.79 ALDH1A1 (0.36) HPGDALDH1A1MAPT
SCHEMBL1038685 0.77 HPGD (0.46) HPGDALDH1A1L3MBTL1MAPTTSHR
SCHEMBL1492015 0.77 HPGD (0.46) HPGDALDH1A1L3MBTL1MAPTTSHR
SCHEMBL5239873 0.77 MAPT (0.34) HPGDALDH1A1L3MBTL1MAPTTSHR
SCHEMBL5239882 0.77 MAPT (0.34) HPGDALDH1A1L3MBTL1MAPTTSHR
SCHEMBL5239879 0.77 MAPT (0.34) HPGDALDH1A1L3MBTL1MAPTTSHR
SCHEMBL3865443 0.75

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
US-20070219234-A1 Thienopyridine Derivatives SANKYO COMPANY, LIMITED (JP) 2007-09-20 US disclosed
EP-1764367-A1 THIENOPYRIDINE DERIVATIVES Sankyo Company, Limited (JP) 2007-03-21 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 (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-20070219234-A1 Thienopyridine Derivatives RASGRP1, NRAS, HRH3 HPGD 2215/4885ALDH1A1 1073/4885L3MBTL1 4177/4885

“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.