SCHEMBL5847997

SCHEMBL5847997

Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(C)(C)Oc1cccc(COC(C)(C)C(=O)O)c1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 16/20 0.55
PPARD Q03181 15/20 0.55
PPARG P37231 9/20 0.55
FFAR1 O14842 2/20 0.45
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL5848526 0.90 PPARA (0.47) PPARAPPARDPPARGFFAR1NPC1
SCHEMBL5848492 0.85 PPARD (0.62) PPARAPPARDPPARGFFAR1
SCHEMBL5848682 0.84 PPARA (0.49) PPARAPPARDPPARG
SCHEMBL7107434 0.83 PPARD (0.60) PPARAPPARDPPARGFFAR1
SCHEMBL5847998 0.82 PPARD (0.48) PPARAPPARDPPARG
SCHEMBL4823495 0.81 PPARA (0.63) PPARAPPARDPPARGFFAR1
SCHEMBL5847993 0.76 PPARD (0.57) PPARAPPARDPPARGFFAR1
SCHEMBL4831871 0.75 PPARD (0.53) PPARAPPARDPPARGFFAR1
SCHEMBL5848523 0.75 KDM4E (0.43) PPARAPPARDPPARGNPC1ALDH1A1
SCHEMBL5849746 0.74 PPARD (0.45) PPARAPPARDPPARGFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7091225-B2 Substituted oxazoles and thiazoles as hPPAR alpha agonists SMITHKLINE BEECHAM CORPORATION (US) 2006-08-15 US claimed
US-20040147571-A1 Substituted oxazoles and thiazoles as hppar alpha agonists SMITHKLINE BEECHAM CORPORATION 2004-07-29 US claimed
US-7091225-B2 Substituted oxazoles and thiazoles as hPPAR alpha agonists SMITHKLINE BEECHAM CORPORATION (US) 2006-08-15 US disclosed
US-20040147571-A1 Substituted oxazoles and thiazoles as hppar alpha agonists SMITHKLINE BEECHAM CORPORATION 2004-07-29 US disclosed
EP-1345916-A1 SUBSTITUTED OXAZOLES AND THIAZOLES AS HPPAR ALPHA AGONISTS GLAXO GROUP LIMITED (GB) 2003-09-24 EP disclosed
WO-2002050047-A1 SUBSTITUED OXAZOLES AND THIAZOLES AS HPPAR ALPHA AGONISTS GLAXO GROUP LIMITED (GB) 2002-06-27 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-20040147571-A1 Substituted oxazoles and thiazoles as hppar alpha agonists GLP1R, GCGR, CCKAR PPARA 281/4885PPARD 265/4885PPARG 199/4885

“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.