SCHEMBL3971665

SCHEMBL3971665

Cc1ccc(SCCC(Oc2ccc3oc4ccccc4c3c2)C(=O)O)c(C)c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 7/20 0.45
LMNA P02545 4/20 0.45
PTGER4 P35408 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
PPARG P37231 4/20 0.39
PPARA Q07869 4/20 0.39
PTPRF P10586 1/20 0.39
PTPRA P18433 1/20 0.39
PTPN7 P35236 1/20 0.39
DUSP3 P51452 1/20 0.39
ALDH1A1 P00352 3/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 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
SCHEMBL11993095 0.91 LMNA (0.47) PTPN1LMNAPTGER4NPSR1RXFP1
SCHEMBL6904181 0.87 PTPN1 (0.38) PTPN1LMNAPTGER4NPSR1RXFP1
SCHEMBL3976050 0.85 LMNA (0.46) PTPN1LMNAPTGER4NPSR1RXFP1
SCHEMBL3979354 0.80 PPARG (0.46) LMNAPPARGPPARA
SCHEMBL3972905 0.79 PPARG (0.54) PPARGPPARA
SCHEMBL3972070 0.79 PPARG (0.45) PTPN1LMNAPPARGPPARAMAPT
SCHEMBL3968405 0.76 PPARG (0.48) PTPN1LMNAPPARGPPARA
SCHEMBL13418750 0.75 PTPN1 (0.63) PTPN1LMNAPTGER4PPARGPPARA
SCHEMBL3978556 0.75 PPARG (0.53) LMNANPSR1PPARGPPARAALDH1A1
SCHEMBL3976053 0.73 LMNA (0.48) LMNAPTGER4NPSR1RXFP1ALDH1A1

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 PTPN1 2689/4885LMNA 743/4885PTGER4 2216/4885

“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.