SCHEMBL1553059

SCHEMBL1553059

Cc1cccc(-c2nc(C)c(COS(C)(=O)=O)o2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VDR P11473 9/20 0.46
PPARD Q03181 7/20 0.46
ESR1 P03372 2/20 0.45
THRA P10827 2/20 0.45
THRB P10828 2/20 0.45
RXRA P19793 2/20 0.45
PPARG P37231 2/20 0.45
PPARA Q07869 2/20 0.45
ESR2 Q92731 2/20 0.45
SLC9A1 P19634 1/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
KDM4E B2RXH2 2/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
NOTUM Q6P988 1/20 0.41
PBRM1 Q86U86 1/20 0.41

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
SCHEMBL4089372 0.77 PPARG (0.49) PPARDTHRBPPARGPPARAKDM4E
SCHEMBL1553828 0.76 NPC1 (0.49) VDRPPARDESR1THRATHRB
SCHEMBL5312815 0.76 NPC1 (0.49) VDRPPARDKDM4ENPC1RAB9A
SCHEMBL6608039 0.74 PPARD (0.41) VDRPPARDPPARGPPARASLC9A1
SCHEMBL1553861 0.72 VDR (0.83) VDRPPARDESR1THRATHRB
SCHEMBL24485092 0.72 CYP1A2 (0.34) KDM4ETSHR
SCHEMBL1554452 0.72 PPARD (0.66) VDRPPARDESR1THRATHRB
SCHEMBL1553104 0.71 NOTUM (0.61) VDRPPARDESR1THRATHRB
SCHEMBL4048480 0.70 MEN1 (0.39) THRBPPARARAB9ASMN1; SMN2NOTUM
SCHEMBL13007421 0.68 ALDH1A1 (0.44) PPARDPPARGPPARAKDM4EHPGD

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-1735303-B1 1,3,4-OXADIAZOL-2-ONES AS PPAR DELTA MODULATORS AND THEIR USE THEREOF AVENTIS PHARMA INC (US) 2011-04-27 EP disclosed
EP-1735303-B1 1,3,4-OXADIAZOL-2-ONES AS PPAR DELTA MODULATORS AND THEIR USE THEREOF AVENTIS PHARMA INC (US) 2011-04-27 EP disclosed
US-7576109-B2 1,3,4-oxadiazol-2-ones as PPAR delta modulators and their use thereof AVENTIS PHARMACEUTICALS INC. (US) 2009-08-18 US disclosed
US-7576109-B2 1,3,4-oxadiazol-2-ones as PPAR delta modulators and their use thereof AVENTIS PHARMACEUTICALS INC. (US) 2009-08-18 US disclosed
US-20070060626-A1 1,3,4-OXADIAZOL-2-ONES AS PPAR DELTA MODULATORS AND THEIR USE THEREOF AVENTIS PHARMACEUTICALS INC. (US) 2007-03-15 US disclosed
US-20070060626-A1 1,3,4-OXADIAZOL-2-ONES AS PPAR DELTA MODULATORS AND THEIR USE THEREOF AVENTIS PHARMACEUTICALS INC. (US) 2007-03-15 US 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-20070060626-A1 1,3,4-OXADIAZOL-2-ONES AS PPAR DELTA MODULATORS AND THEIR USE THEREOF PPARD, PPARA, PPARG VDR 32/4885PPARD 1/4885ESR1 2811/4885

“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.