SCHEMBL1929945

SCHEMBL1929945

CCc1oc(-c2cccc(OC)c2)nc1CO[C@H]1CCCC(COC(C)(C)C(=O)OC(C)(C)C)C1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
VDR P11473 9/20 0.38
PPARD Q03181 7/20 0.38
PPARG P37231 3/20 0.38
PPARA Q07869 3/20 0.38
ESR1 P03372 2/20 0.38
THRA P10827 2/20 0.38
THRB P10828 2/20 0.38
RXRA P19793 2/20 0.38
ESR2 Q92731 2/20 0.38
LMNA P02545 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL1929942 1.00 ALDH1A1 (0.38) ALDH1A1KMT2ASMN1; SMN2VDRPPARD
SCHEMBL1928969 0.92 SLC16A3 (0.43) ALDH1A1KMT2ASMN1; SMN2VDRPPARD
SCHEMBL1928971 0.92 SLC16A3 (0.43) ALDH1A1KMT2ASMN1; SMN2VDRPPARD
SCHEMBL3975273 0.91 PPARD (0.37) ALDH1A1KMT2ASMN1; SMN2VDRPPARD
SCHEMBL1928450 0.90 VDR (0.38) ALDH1A1KMT2ASMN1; SMN2VDRPPARD
SCHEMBL1927836 0.86 PPARD (0.40) ALDH1A1KMT2ASMN1; SMN2VDRPPARD
SCHEMBL1927831 0.86 PPARD (0.40) ALDH1A1KMT2ASMN1; SMN2VDRPPARD
SCHEMBL1929950 0.85 PPARA (0.42) VDRPPARDPPARGPPARAESR1
SCHEMBL1929951 0.85 PPARA (0.42) VDRPPARDPPARGPPARAESR1
SCHEMBL3974627 0.83 ALDH1A1 (0.47) ALDH1A1KMT2ASMN1; SMN2PPARDPPARG

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-7956077-B2 2-{-3,′2-(phenyl)-oxazol-4-ylmethoxyl-cyclohexyl methoxy}-propionic acid derivatives used as peroxisome proliferator-activated receptor (PPAR) ligands for the treatment of hyperlipidemia and diabetes SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2011-06-07 US disclosed
US-20070197613-A1 2-{-3,'2-(PHENYL)-OXAZOL-4-YLMETHOXYL-CYCLOHEXYL METHOXY}-PROPIONIC ACID DERIVATIVES USED 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-20070197613-A1 2-{-3,'2-(PHENYL)-OXAZOL-4-YLMETHOXYL-CYCLOHEXYL METHOXY}-PROPIONIC ACID DERIVATIVES USED AS PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR (PPAR) LIGANDS FOR THE TREATMENT OF HYPERLIPIDEMIA AND DIABETES PPARA, PPARG, PPARD ALDH1A1 468/4885KMT2A 1805/4885SMN1; SMN2 4804/4885

“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.