SCHEMBL6006682

SCHEMBL6006682

COC(Cc1ccc(Cl)c(Cl)c1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 12/20 0.56
PPARG P37231 10/20 0.56
PPARD Q03181 5/20 0.54
TSHR P16473 2/20 0.51
PNMT P11086 1/20 0.49
LDHA P00338 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
TACR1 P25103 1/20 0.43
FFAR1 O14842 1/20 0.43
MMP1 P03956 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
SCHEMBL15446337 0.84 SRR (0.60) PPARAPPARGTSHRPNMT
SCHEMBL18039176 0.83 PPARG (0.81) PPARAPPARG
SCHEMBL29406517 0.81 PPARA (0.68) PPARAPPARGPPARD
SCHEMBL23933856 0.79 PPARA (0.54) PPARAPPARGPPARDPNMT
SCHEMBL23933859 0.79 PPARA (0.54) PPARAPPARGPPARDPNMT
SCHEMBL4439324 0.79 PNMT (0.53) PPARAPPARGTSHRPNMTLDHA
SCHEMBL20420631 0.79 KDM6B (0.60) PPARAPPARGPPARDTSHRMMP1
SCHEMBL5607348 0.78 PPARA (0.55) PPARAPPARGPPARDLDHAFFAR1
SCHEMBL5130053 0.78 PNMT (0.58) PPARAPPARGPPARDTSHRPNMT
SCHEMBL6003855 0.78 PNMT (0.58) PPARAPPARGPPARDTSHRPNMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7105509-B2 Benzodiazepine derivatives as APP modulators MERCK SHARP & DOHME LIMITED (GB) 2006-09-12 US disclosed
US-20040082572-A1 Benzodiazepine derivatives as app modulators MERCK SHARPE & DOHME LIMITED (GB) 2004-04-29 US disclosed
EP-1294702-A1 BENZODIAZEPINE DERIVATIVES AS APP MODULATORS MERCK SHARP & DOHME LTD. (GB) 2003-03-26 EP disclosed
WO-2001090084-A1 BENZODIAZEPINE DERIVATIVES AS APP MODULATORS MERCK SHARP & DOHME LIMITED (GB) 2001-11-29 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-20040082572-A1 Benzodiazepine derivatives as app modulators BACE1, PSEN1, APP PPARA 350/4885PPARG 255/4885PPARD 150/4885

“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.