SCHEMBL3753667

SCHEMBL3753667

Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(OCC(F)(F)F)c1ccc(-c2noc(=O)[nH]2)c(Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 13/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
PPARA Q07869 4/20 0.36
CMKLR1 Q99788 1/20 0.36
FFAR1 O14842 2/20 0.35
CHRM5 P08912 1/20 0.35
SLC6A3 Q01959 1/20 0.35
AGTR1 P30556 1/20 0.34
MDM2 Q00987 1/20 0.34
FTO Q9C0B1 1/20 0.33

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
SCHEMBL3743853 0.91 NPC1 (0.36) PPARDNPC1ALDH1A1GAAPPARA
SCHEMBL3530757 0.89 CASP3 (0.35) CMKLR1AGTR1MDM2FTO
SCHEMBL3745605 0.88 PLAT (0.36) PPARDNPC1ALDH1A1GAAPPARA
SCHEMBL3741440 0.87 NPC1 (0.36) PPARDNPC1ALDH1A1GAAPPARA
SCHEMBL3529214 0.84 DGAT1 (0.34) ALDH1A1CMKLR1AGTR1MDM2FTO
SCHEMBL3743783 0.84 PPARD (0.38) PPARDNPC1ALDH1A1GAAPPARA
SCHEMBL3752227 0.83 NPC1 (0.36) PPARDNPC1ALDH1A1GAAPPARA
SCHEMBL3746555 0.83 PPARD (0.40) PPARDPPARAFFAR1CHRM5SLC6A3
SCHEMBL3753664 0.83 PPARD (0.36) PPARDNPC1ALDH1A1GAAPPARA
SCHEMBL3744980 0.82 ALDH1A1 (0.38) PPARDNPC1ALDH1A1GAAPPARA

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
EP-1931660-B1 PHENYL-[1,2,4]-OXADIAZOL-5-ONE DERIVATIVES WITH PHENYL GROUP, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2012-08-01 EP claimed
EP-1931660-B1 PHENYL-[1,2,4]-OXADIAZOL-5-ONE DERIVATIVES WITH PHENYL GROUP, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2012-08-01 EP disclosed
US-7834030-B2 Phenyl-[1,2,4]-oxadiazol-5-one derivatives, pharmaceutical compositions and therapeutic use thereof SANOFI-AVENTIS (FR) 2010-11-16 US disclosed
US-20080262036-A1 Phenyl-[1,2,4]-oxadiazol-5-one Derivatives, Pharmaceutical Compositions and Therapeutic Use Thereof SANOFI-AVENTIS (FR) 2008-10-23 US disclosed
EP-1931660-A2 PHENYL-[1,2,4]-OXADIAZOL-5-ONE DERIVATIVES WITH PHENYL GROUP, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS Sanofi-Aventis (FR) 2008-06-18 EP disclosed
WO-2007039178-A2 PHENYL-[1,2,4]-OXADIAZOL-5-ONE DERIVATIVES WITH PHENYL GROUP, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS (DE) 2007-04-12 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-20080262036-A1 Phenyl-[1,2,4]-oxadiazol-5-one Derivatives, Pharmaceutical Compositions and Therapeutic Use Thereof GPR119, CPT1A, PC PPARD 63/4885NPC1 516/4885ALDH1A1 978/4885

“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.