SCHEMBL5634599

SCHEMBL5634599

CC(=O)c1cccc(Nc2ncc(C(=O)c3ccccc3C)s2)c1

nearest known ligand 0.70

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 8/20 0.60
MAPK12 P53778 8/20 0.60
MAPK11 Q15759 8/20 0.60
MAPK14 Q16539 8/20 0.60
NPC1 O15118 1/20 0.59
RAB9A P51151 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
KMT2A Q03164 1/20 0.52

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
SCHEMBL5395402 0.91 MAPK13 (0.59) MAPK13MAPK12MAPK11MAPK14NPC1
SCHEMBL5634206 0.89 RAB9A (0.63) MAPK13MAPK12MAPK11MAPK14NPC1
SCHEMBL5634606 0.88 MAPK13 (0.77) MAPK13MAPK12MAPK11MAPK14KMT2A
SCHEMBL5635540 0.88 MAPK13 (0.59) MAPK13MAPK12MAPK11MAPK14NPC1
SCHEMBL5634600 0.87 NPC1 (0.70) MAPK13MAPK12MAPK11MAPK14NPC1
SCHEMBL5635193 0.85 MAPK13 (0.62) MAPK13MAPK12MAPK11MAPK14NPC1
SCHEMBL5634628 0.85 MAPK13 (0.57) MAPK13MAPK12MAPK11MAPK14NPC1
SCHEMBL5395408 0.85 MAPK13 (0.76) MAPK13MAPK12MAPK11MAPK14NPC1
SCHEMBL5559793 0.84 MAPK13 (0.52) MAPK13MAPK12MAPK11MAPK14NPC1
SCHEMBL5635337 0.83 MAPK13 (0.68) MAPK13MAPK12MAPK11MAPK14NPC1

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-7253197-B2 Aminothiazole derivatives HOFFMANN-LA ROCHE INC. (US) 2007-08-07 US claimed
EP-1539722-A1 THIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2005-06-15 EP claimed
US-20040038990-A1 Aminothiazole derivatives HOFFMANN-LA ROCHE INC. 2004-02-26 US claimed
WO-2004014884-A1 THIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2004-02-19 WO claimed
US-7253197-B2 Aminothiazole derivatives HOFFMANN-LA ROCHE INC. (US) 2007-08-07 US disclosed
EP-1539722-A1 THIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2005-06-15 EP disclosed
US-20040038990-A1 Aminothiazole derivatives HOFFMANN-LA ROCHE INC. 2004-02-26 US disclosed
WO-2004014884-A1 THIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2004-02-19 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-20040038990-A1 Aminothiazole derivatives FABP4, GPR119, ABAT MAPK13 3018/4885MAPK12 2608/4885MAPK11 2347/4885

“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.