SCHEMBL5437274

SCHEMBL5437274

COc1ccc(OC(=O)N(CC(=O)O)Cc2ccc(OCCN3CCc4sccc4C3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 8/20 0.46
PPARG P37231 5/20 0.46
ABCB1 P08183 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
KCNA5 P22460 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
DRD3 P35462 4/20 0.39
DRD2 P14416 1/20 0.39
LTA4H P09960 1/20 0.39

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
SCHEMBL14360873 0.93 ABCB1 (0.42) PPARAPPARGABCB1MEN1KMT2A
SCHEMBL5430183 0.84 PPARG (0.41) PPARAPPARGABCB1MEN1KMT2A
SCHEMBL5437303 0.80 PPARA (0.54) PPARAPPARGDRD3LTA4H
SCHEMBL5423669 0.73 PPARA (0.54) PPARAPPARGMEN1KMT2A
SCHEMBL5441860 0.72 PPARA (0.56) PPARAPPARG
SCHEMBL5434311 0.72 PPARA (0.52) PPARAPPARGDRD3
SCHEMBL5434312 0.71 PPARA (0.56) PPARAPPARGMEN1KMT2A
SCHEMBL5428115 0.71 PPARA (0.56) PPARAPPARG
SCHEMBL5428793 0.71 PPARA (0.52) PPARAPPARGDRD3
SCHEMBL10623622 0.70 ABCB1 (0.57) ABCB1KMT2ADRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005049589-A2 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF HYPERLIPIDEMIA, DIABETES, OBESITY AND SIMILAR DISEASES CADILA HEALTHCARE LIMITED (IN) 2005-06-02 WO claimed
US-20070275956-A1 Novel Heterocyclic Compounds CADILA HEALTHCARE LIMITED (IN) 2007-11-29 US disclosed
WO-2005049589-A2 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF HYPERLIPIDEMIA, DIABETES, OBESITY AND SIMILAR DISEASES CADILA HEALTHCARE LIMITED (IN) 2005-06-02 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-20070275956-A1 Novel Heterocyclic Compounds CYP46A1, DHCR7, NPC1L1 PPARA 990/4885PPARG 615/4885ABCB1 159/4885

“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.