SCHEMBL5216376

SCHEMBL5216376

CCOC(=O)C(C)(C)Oc1ccc(C(C)NC(=O)c2sc(-c3ccc(C(F)(F)F)cc3)nc2C)c(C)c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 16/20 0.55
PPARD Q03181 7/20 0.55
PPARG P37231 4/20 0.55
NPC1 O15118 1/20 0.51
ALDH1A1 P00352 1/20 0.51
GAA P10253 1/20 0.51
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45
HSP90AA1 P07900 1/20 0.45
MAPT P10636 1/20 0.45
CRHBP P24387 1/20 0.45
KMT2A Q03164 1/20 0.45
CRHR2 Q13324 1/20 0.45
ROCK1 Q13464 1/20 0.44
NR1H4 Q96RI1 1/20 0.44

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
SCHEMBL5219857 0.90 PPARA (0.67) PPARAPPARDPPARGNPC1ALDH1A1
SCHEMBL6582734 0.89 PPARA (0.60) PPARAPPARDPPARGNPC1ALDH1A1
SCHEMBL5185069 0.81 PPARA (0.82) PPARAPPARDPPARG
SCHEMBL6582740 0.79 PPARA (0.82) PPARAPPARDPPARGNPC1ALDH1A1
SCHEMBL6582457 0.78 PPARA (0.74) PPARAPPARDPPARGNPC1ALDH1A1
SCHEMBL4830364 0.77 PPARD (0.51) PPARAPPARDPPARG
SCHEMBL4826471 0.77 PPARD (0.51) PPARAPPARDPPARG
SCHEMBL6586282 0.77 PPARA (0.53) PPARAPPARDPPARGNPC1ALDH1A1
SCHEMBL4826476 0.77 PPARD (0.51) PPARAPPARDPPARG
SCHEMBL6583596 0.76 PPARA (0.64) PPARAPPARDPPARGNPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1392665-B1 THIAZOLE OR OXAZOLE DERIVATIVES WHICH ARE USEFUL IN THE TREATMENT OF CARDIOVASCULAR AND RELATED DISEASES GLAXO GROUP LTD (GB) 2007-10-31 EP claimed
US-6867225-B2 Thiazole or oxazole derivatives which are useful in the treatment of cardiovascular and related diseases SMITHKLINE BEECHAM CORPORATION (US) 2005-03-15 US claimed
US-20040176427-A1 Thiazole or oxazole derivatives which are useful in the treatment of cardiovascular and related diseases GLAXO GROUP LIMITED (GB) 2004-09-09 US claimed
EP-1392665-B1 THIAZOLE OR OXAZOLE DERIVATIVES WHICH ARE USEFUL IN THE TREATMENT OF CARDIOVASCULAR AND RELATED DISEASES GLAXO GROUP LTD (GB) 2007-10-31 EP disclosed
US-6867225-B2 Thiazole or oxazole derivatives which are useful in the treatment of cardiovascular and related diseases SMITHKLINE BEECHAM CORPORATION (US) 2005-03-15 US disclosed
EP-1392665-A1 THIAZOLE OR OXAZOLE DERIVATIVES WHICH ARE USEFUL IN THE TREATMENT OF CARDIOVASCULAR AND RELATED DISEASES GLAXO GROUP LIMITED (GB) 2004-03-03 EP disclosed
WO-2002096894-A1 THIAZOLE OR OXAZOLE DERIVATIVES WHICH ARE USEFUL IN THE TREATMENT OF CARDIOVASCULAR AND RELATED DISEASES GLAXO GROUP LIMITED (GB) 2002-12-05 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-20040176427-A1 Thiazole or oxazole derivatives which are useful in the treatment of cardiovascular and related diseases NCEH1, OXER1, THOP1 PPARA 515/4885PPARD 379/4885PPARG 312/4885

“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.