SCHEMBL4350811

SCHEMBL4350811

O=C1N=C(N2CCSCC2)SC1=Cc1cccc(C(=O)O)c1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.58
KMT2A Q03164 4/20 0.57
MAPT P10636 3/20 0.57
HTT P42858 1/20 0.57
ENPP2 Q13822 2/20 0.53
DCTPP1 Q9H773 1/20 0.51
HPGD P15428 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
MEN1 O00255 3/20 0.47
GRIN1 Q05586 2/20 0.47
GRIN2B Q13224 2/20 0.47
RAB9A P51151 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
MCHR1 Q99705 1/20 0.46
SENP1 Q9P0U3 1/20 0.46
NPC1 O15118 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
SCHEMBL4350808 1.00 ALDH1A1 (0.58) ALDH1A1KMT2AMAPTHTTENPP2
SCHEMBL4346380 0.86 ALDH1A1 (0.60) ALDH1A1KMT2AMAPTHTTENPP2
SCHEMBL4346381 0.86 ALDH1A1 (0.60) ALDH1A1KMT2AMAPTHTTENPP2
SCHEMBL4352578 0.84 ALDH1A1 (0.80) ALDH1A1KMT2AMAPTHTTDCTPP1
SCHEMBL4352583 0.84 ALDH1A1 (0.80) ALDH1A1KMT2AMAPTHTTDCTPP1
SCHEMBL4351687 0.83 ENPP2 (0.70) ALDH1A1KMT2AMAPTHTTENPP2
SCHEMBL4351685 0.83 ENPP2 (0.70) ALDH1A1KMT2AMAPTHTTENPP2
SCHEMBL4358669 0.82 ENPP2 (0.54) ALDH1A1KMT2AMAPTHTTENPP2
SCHEMBL4348029 0.82 ENPP2 (0.54) ALDH1A1KMT2AMAPTHTTENPP2
SCHEMBL4355053 0.80 ALDH1A1 (0.57) ALDH1A1KMT2AMAPTHTTENPP2

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 ALDH1A1 284/4885KMT2A 3923/4885MAPT 1470/4885

“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.