SCHEMBL4576134

SCHEMBL4576134

CCc1cnc(N(CCc2ccc(OCC(=O)O)c(Cl)c2)Cc2ccc(OC(F)(F)F)cc2)nc1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 10/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.42
PPARA Q07869 2/20 0.41
ADRB3 P13945 4/20 0.40
CYP2C19 P33261 1/20 0.39
PTPN1 P18031 2/20 0.39
MRGPRX4 Q96LA9 1/20 0.38
TRPV1 Q8NER1 1/20 0.38

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
SCHEMBL4575688 0.90 PPARD (0.52) PPARD
SCHEMBL4575177 0.90 PPARD (0.43) PPARDPPARACYP2C19PTPN1
SCHEMBL4576287 0.89 PPARD (0.43) PPARDPPARAPTPN1
SCHEMBL4575952 0.89 PPARA (0.50) PPARDPTGDR2PPARA
SCHEMBL4574774 0.87 PTGDR2 (0.41) PPARDPTGDR2PPARAMRGPRX4TRPV1
SCHEMBL4575101 0.87 FFAR1 (0.41) PPARDPPARAPTPN1
SCHEMBL4575581 0.86 CYP2C19 (0.47) PPARDPTGDR2PPARACYP2C19PTPN1
SCHEMBL4575425 0.84 NR1H2 (0.40) TRPV1
SCHEMBL4576272 0.81 PPARA (0.44) PPARDPTGDR2PPARA
SCHEMBL4575453 0.81 PPARA (0.49) PPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7319104-B2 hPPARs activators SMITHKLINE BEECHAM CORPORATION (US) 2008-01-15 US claimed
US-20050137212-A1 Hppars activators SMITHKLINE BEECHAM CORPORATION 2005-06-23 US claimed
EP-1480957-A1 HPPARS ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2004-12-01 EP claimed
WO-2003074495-A1 HPPARS ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2003-09-12 WO claimed
US-7319104-B2 hPPARs activators SMITHKLINE BEECHAM CORPORATION (US) 2008-01-15 US disclosed
US-7319104-B2 hPPARs activators SMITHKLINE BEECHAM CORPORATION (US) 2008-01-15 US disclosed
US-7319104-B2 hPPARs activators SMITHKLINE BEECHAM CORPORATION (US) 2008-01-15 US disclosed
US-20050137212-A1 Hppars activators SMITHKLINE BEECHAM CORPORATION 2005-06-23 US disclosed
EP-1480957-A1 HPPARS ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2004-12-01 EP disclosed
WO-2003074495-A1 HPPARS ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2003-09-12 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-20050137212-A1 Hppars activators PPARG, PPARA, PPARD PPARD 3/4885PTGDR2 332/4885PPARA 2/4885

“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.