SCHEMBL3973021

SCHEMBL3973021

Cc1cccc(SCCC(Oc2ccc(OC(F)(F)F)cc2)C(=O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 15/20 0.47
PPARA Q07869 13/20 0.47
PPARD Q03181 1/20 0.38
ALOX5 P09917 1/20 0.38
ELANE P08246 1/20 0.37
CTSL P07711 1/20 0.37
CTSS P25774 1/20 0.37
CTSK P43235 1/20 0.37

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
SCHEMBL3976202 0.89 PPARG (0.51) PPARGPPARAPPARDALOX5
SCHEMBL11993021 0.89 PPARG (0.51) PPARGPPARAPPARDALOX5
SCHEMBL3973024 0.86 PPARG (0.46) PPARGPPARAPPARDALOX5
SCHEMBL6904181 0.83 PTPN1 (0.38) PPARGPPARAPPARD
SCHEMBL6903473 0.82 PPARG (0.44) PPARGPPARAPPARD
SCHEMBL11992997 0.80 PPARG (0.43) PPARGPPARA
SCHEMBL16712021 0.77 PPARG (0.47) PPARGPPARA
SCHEMBL3976050 0.77 LMNA (0.46) PPARGPPARA
SCHEMBL3973311 0.76 PPARG (0.54) PPARGPPARA
SCHEMBL3967738 0.76 PPARG (0.62) PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7491747-B2 4-(Arylthio)- or (4-heteroarylthio)butyric acid derivatives that may be used in the treatment of dyslipidaemia, atherosclerosis and diabetes MERCK PATENT GMBH (DE) 2009-02-17 US disclosed
US-20050020651-A1 Butyric acid derivatives MERCK PATENT GMBH (DE) 2005-01-27 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-20050020651-A1 Butyric acid derivatives GPR119, DBI, GABRB1 PPARG 492/4885PPARA 425/4885PPARD 596/4885

“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.