SCHEMBL5034739

SCHEMBL5034739

COc1ccc(N(C(=O)c2ccc(Cl)cc2Cl)c2ncc(C(=O)N3CCC[C@@H]3C#N)s2)cc1OC

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 12/20 0.43
PREP P48147 7/20 0.39
GRIA2 P42262 1/20 0.37
DPP8 Q6V1X1 5/20 0.36
DPP9 Q86TI2 3/20 0.36
DPP7 Q9UHL4 3/20 0.36
FAP Q12884 2/20 0.36
GRM5 P41594 1/20 0.36

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
SCHEMBL5034737 1.00 DPP4 (0.43) DPP4PREPGRIA2DPP8DPP9
SCHEMBL14190191 1.00 DPP4 (0.43) DPP4PREPGRIA2DPP8DPP9
SCHEMBL5034848 0.89 HSD11B1 (0.41) GRM5
SCHEMBL5032578 0.87 HCRTR1 (0.39) DPP4PREPDPP8DPP9DPP7
SCHEMBL14190189 0.87 HCRTR1 (0.39) DPP4PREPDPP8DPP9DPP7
SCHEMBL5032582 0.87 HCRTR1 (0.39) DPP4PREPDPP8DPP9DPP7
SCHEMBL5035256 0.85 KMT2A (0.41) GRM5
SCHEMBL5034894 0.84 RAB9A (0.40)
SCHEMBL5036600 0.81 HPGD (0.43)
SCHEMBL5035234 0.80 ALDH1A1 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7371751-B2 Thiazole derivatives HOFFMANN-LA ROCHE INC. (US) 2008-05-13 US claimed
EP-1694673-B1 THIAZOLE DERIVATES HOFFMANN LA ROCHE (CH) 2008-01-16 EP claimed
US-20050153962-A1 Thiazole derivatives HOFFMANN-LA ROCHE INC. 2005-07-14 US claimed
US-7371751-B2 Thiazole derivatives HOFFMANN-LA ROCHE INC. (US) 2008-05-13 US disclosed
EP-1694673-B1 THIAZOLE DERIVATES HOFFMANN LA ROCHE (CH) 2008-01-16 EP disclosed
EP-1694673-A1 NOVEL THIAZOLE DERIVATES F.HOFFMANN-LA ROCHE AG (CH) 2006-08-30 EP disclosed
US-20050153962-A1 Thiazole derivatives HOFFMANN-LA ROCHE INC. 2005-07-14 US disclosed
WO-2005058887-A1 NOVEL THIAZOLE DERIVATES F. HOFFMANN-LA ROCHE AG (CH) 2005-06-30 WO 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-20050153962-A1 Thiazole derivatives CNR1, CNR2, GPR119 DPP4 973/4885PREP 3229/4885GRIA2 777/4885

“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.