SCHEMBL4346451

SCHEMBL4346451

O=C1N=C(N2CCN(c3nsnc3Cl)CC2)S/C1=C/c1cccc(C(=O)N2CCN(Cc3ccccc3)CC2)c1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 4/20 0.56
GRIN2B Q13224 4/20 0.56
ENPP2 Q13822 4/20 0.55
MAPT P10636 2/20 0.51
HDAC1 Q13547 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ALDH1A1 P00352 3/20 0.44
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.42
HTR1A P08908 1/20 0.42

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
SCHEMBL4360872 1.00 GRIN1 (0.56) GRIN1GRIN2BENPP2MAPTHDAC1
SCHEMBL4360877 1.00 GRIN1 (0.56) GRIN1GRIN2BENPP2MAPTHDAC1
SCHEMBL4346453 1.00 GRIN1 (0.56) GRIN1GRIN2BENPP2MAPTHDAC1
SCHEMBL4351665 0.92 ALDH1A1 (0.48) GRIN1GRIN2BENPP2MAPTHDAC1
SCHEMBL4351666 0.92 ALDH1A1 (0.48) GRIN1GRIN2BENPP2MAPTHDAC1
SCHEMBL4352349 0.88 ALDH1A1 (0.45) GRIN1GRIN2BENPP2MAPTHDAC1
SCHEMBL4352354 0.88 ALDH1A1 (0.45) GRIN1GRIN2BENPP2MAPTHDAC1
SCHEMBL4356182 0.85 ENPP2 (0.43) ENPP2MAPTHDAC1SMN1; SMN2KMT2A
SCHEMBL4356185 0.85 ENPP2 (0.43) ENPP2MAPTHDAC1SMN1; SMN2KMT2A
SCHEMBL4358669 0.85 ENPP2 (0.54) GRIN1GRIN2BENPP2MAPTHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1890695-B1 USE OF 2,5-DISUBSTITUTED THIAZOL-4-ONE DERIVATIVES IN DRUGS GRUENENTHAL GMBH (DE) 2013-02-20 EP claimed
US-20090215758-A1 Use of 2,5-Disubstituted Thiazol-4-One Derivatives in Drugs GRUENENTHAL GMBH (DE) 2009-08-27 US claimed
US-20090215758-A1 Use of 2,5-Disubstituted Thiazol-4-One Derivatives in Drugs GRUENENTHAL GMBH (DE) 2009-08-27 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-20090215758-A1 Use of 2,5-Disubstituted Thiazol-4-One Derivatives in Drugs ABCB1, ABCG2, SLC5A2 GRIN1 1485/4885GRIN2B 1366/4885ENPP2 1946/4885

“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.