SCHEMBL5423680

SCHEMBL5423680

CCC(C(=O)O)N(Cc1ccc(OCCc2c(-c3ccccc3)noc2C)cc1)C(=O)Oc1ccc(OC)cc1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 11/20 0.51
PPARG P37231 11/20 0.51
POLB P06746 1/20 0.42
ATM Q13315 1/20 0.42
PPARD Q03181 8/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NR1H4 Q96RI1 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
SCHEMBL6504989 0.84 PPARA (0.69) PPARAPPARGPOLBATMPPARD
SCHEMBL6060712 0.83 PPARG (0.73) PPARAPPARGPPARD
SCHEMBL5430605 0.76 PPARG (0.45) PPARAPPARGPOLB
SCHEMBL5430485 0.76 PPARG (0.58) PPARAPPARGPPARD
SCHEMBL5434396 0.75 PPARG (0.58) PPARAPPARGPPARD
SCHEMBL5458257 0.75 LMNA (0.43) PPARAPPARG
SCHEMBL5461251 0.75 PPARG (0.50) PPARAPPARG
SCHEMBL5434713 0.75 PPARG (0.59) PPARAPPARG
SCHEMBL5434424 0.74 PPARG (0.55) PPARAPPARG
SCHEMBL5440280 0.74 PPARA (0.57) PPARAPPARGPPARD

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 615/4885POLB 4045/4885

“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.