SCHEMBL5430265

SCHEMBL5430265

CCC(C(=O)O)N(Cc1ccc(OCCn2c(=O)cc(C)n(CC)c2=S)cc1)C(=O)Oc1ccc(OC)cc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 8/20 0.35
PPARG P37231 6/20 0.35
PGR P06401 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
CHRM1 P11229 1/20 0.35
TBXA2R P21731 1/20 0.35
PTGS1 P23219 1/20 0.35
SLC6A2 P23975 1/20 0.35
PDE4A P27815 1/20 0.35
ADRA1A P35348 1/20 0.35
DRD3 P35462 1/20 0.35
POLB P06746 2/20 0.34
KLK1 P06870 1/20 0.33
MAPT P10636 1/20 0.32
PLA2G4A P47712 1/20 0.32
PPARD Q03181 1/20 0.32

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
SCHEMBL5424327 0.85 PPARA (0.48) PPARAPPARGPOLBKLK1
SCHEMBL6505582 0.79 PPARG (0.54) PPARAPPARGPOLBPPARD
SCHEMBL5431889 0.77 PGR (0.61) PPARAPPARGPGRADORA3CHRM1
SCHEMBL5438448 0.77 PGR (0.43) PPARAPPARGPGRADORA3CHRM1
SCHEMBL5432386 0.75 POLB (0.51) DRD3POLB
SCHEMBL5433464 0.75 DRD3 (0.45) PGRADORA3CHRM1TBXA2RPTGS1
SCHEMBL5437283 0.74 KMT2A (0.40) PPARAPPARGPOLBMAPT
SCHEMBL5440280 0.74 PPARA (0.57) PPARAPPARGPPARD
SCHEMBL5431844 0.74 PPARG (0.44) PPARAPPARGPOLBMAPT
SCHEMBL5422779 0.73 TAS2R14 (0.45) PPARAPPARGMAPT

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
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

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 615/4885PGR 4095/4885

“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.