SCHEMBL4245045

SCHEMBL4245045

Cc1oc(C(C)(C)C)nc1CCOc1ccc(C[C@H]2CO[C@](C)(C(=O)O)OC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 20/20 1.00
PPARG P37231 16/20 1.00
CYP2C9 P11712 2/20 0.43
CYP3A4 P08684 1/20 0.43
KCNH2 Q12809 1/20 0.43
PPARD Q03181 1/20 0.43

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
SCHEMBL4245038 1.00 PPARA (1.00) PPARAPPARGCYP2C9CYP3A4KCNH2
SCHEMBL4253557 1.00 PPARA (1.00) PPARAPPARGCYP2C9CYP3A4KCNH2
SCHEMBL4248148 0.91 PPARA (0.84) PPARAPPARG
SCHEMBL4249420 0.91 PPARA (0.84) PPARAPPARG
SCHEMBL4249419 0.91 PPARA (0.84) PPARAPPARG
SCHEMBL4248436 0.91 PPARA (0.83) PPARAPPARGCYP2C9CYP3A4KCNH2
SCHEMBL4246485 0.91 PPARA (0.83) PPARAPPARGCYP2C9CYP3A4KCNH2
SCHEMBL4243498 0.84 PPARG (1.00) PPARAPPARG
SCHEMBL4243493 0.84 PPARG (1.00) PPARAPPARG
SCHEMBL4246877 0.84 PPARG (1.00) PPARAPPARG

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-20090012069-A1 Novel Antidiabetic Compounds CADILA HEALTHCARE LIMITED (IN) 2009-01-08 US claimed
US-20090012069-A1 Novel Antidiabetic Compounds CADILA HEALTHCARE LIMITED (IN) 2009-01-08 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-20090012069-A1 Novel Antidiabetic Compounds GPR119, SLC5A1, SLC5A2 PPARA 145/4885PPARG 76/4885CYP2C9 343/4885

“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.