SCHEMBL4479975

SCHEMBL4479975

COc1cccc(-c2nc(COC[C@H]3CCCC(COC(C)(C)C(=O)O)C3)c(C(C)C)o2)c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 9/20 0.43
SLC16A1 P53985 9/20 0.43
MCTS1 Q9ULC4 5/20 0.40
ALDH1A1 P00352 2/20 0.40
KMT2A Q03164 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 1/20 0.40
VDR P11473 2/20 0.39
PPARD Q03181 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 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
SCHEMBL4386204 1.00 SLC16A3 (0.43) SLC16A3SLC16A1MCTS1ALDH1A1KMT2A
SCHEMBL4494281 1.00 SLC16A3 (0.43) SLC16A3SLC16A1MCTS1ALDH1A1KMT2A
SCHEMBL4386165 1.00 SLC16A3 (0.43) SLC16A3SLC16A1MCTS1ALDH1A1KMT2A
SCHEMBL4383910 0.96 SLC16A3 (0.42) SLC16A3SLC16A1MCTS1ALDH1A1KMT2A
SCHEMBL4389989 0.96 SLC16A3 (0.42) SLC16A3SLC16A1MCTS1ALDH1A1KMT2A
SCHEMBL1929476 0.91 SLC16A3 (0.43) SLC16A3SLC16A1MCTS1ALDH1A1KMT2A
SCHEMBL1930245 0.91 SLC16A3 (0.43) SLC16A3SLC16A1MCTS1ALDH1A1KMT2A
SCHEMBL1930244 0.91 SLC16A3 (0.43) SLC16A3SLC16A1MCTS1ALDH1A1KMT2A
SCHEMBL4386902 0.90 SLC16A3 (0.44) SLC16A3SLC16A1MCTS1ALDH1A1KMT2A
SCHEMBL4386900 0.90 SLC16A3 (0.44) SLC16A3SLC16A1MCTS1ALDH1A1KMT2A

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-7538131-B2 2-{-3-′2-(phenyl)-oxazol-4-ylmethoxymethyl-cyclohexylmethoxy}-propionic acid derivatives useful as peroxisome proliferator-activated receptor (PPAR) ligands for the treatment of hyperlipidemia and diabetes SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2009-05-26 US disclosed
US-20070197612-A1 2-{-3-'2-(PHENYL)-OXAZOL-4-YLMETHOXYMETHYL-CYCLOHEXYLMETHOXY}-PROPIONIC ACID DERIVATIVES USEFUL AS PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR (PPAR) LIGANDS FOR THE TREATMENT OF HYPERLIPIDEMIA AND DIABETES SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-08-23 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-20070197612-A1 2-{-3-'2-(PHENYL)-OXAZOL-4-YLMETHOXYMETHYL-CYCLOHEXYLMETHOXY}-PROPIONIC ACID DERIVATIVES USEFUL AS PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR (PPAR) LIGANDS FOR THE TREATMENT OF HYPERLIPIDEMIA AND DIABETES PPARA, PPARG, PPARD SLC16A3 995/4885SLC16A1 1160/4885MCTS1 3988/4885

“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.