SCHEMBL5558839

SCHEMBL5558839

Cc1oc(C2CCCCC2)nc1CCl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.39
PPARA Q07869 5/20 0.39
PPARD Q03181 1/20 0.39
ALDH1A1 P00352 4/20 0.36
ALOX15B O15296 1/20 0.36
RAB9A P51151 3/20 0.36
NPC1 O15118 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
CYP2C19 P33261 3/20 0.34
CASP3 P42574 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
ADCY1 Q08828 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30

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
SCHEMBL5563195 0.91 PPARG (0.32) PPARGPPARAPPARDALDH1A1RAB9A
SCHEMBL9097721 0.83 PPARG (0.42) PPARGPPARAPPARDALDH1A1ALOX15B
SCHEMBL10810549 0.81 PPARG (0.40) PPARGPPARAPPARDALDH1A1ALOX15B
SCHEMBL5557196 0.80 PPARG (0.38) PPARGPPARAPPARDALDH1A1ALOX15B
SCHEMBL4484815 0.80 PPARG (0.45) PPARGPPARAPPARDALDH1A1ALOX15B
SCHEMBL4474884 0.78 PPARG (0.43) PPARGPPARAPPARDALDH1A1RAB9A
SCHEMBL5116467 0.78 PPARG (0.46) PPARGPPARAPPARDNPC1CYP2C19
SCHEMBL10810604 0.78 PPARG (0.46) PPARGPPARAPPARDNPC1CYP2C19
SCHEMBL3531891 0.76 ALDH1A1 (0.39) ALDH1A1ALOX15BRAB9ANPC1SMN1; SMN2
SCHEMBL10807845 0.76 KDM4E (0.47) PPARGPPARAPPARDNPC1CYP2C19

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1711084-B Substituted 4-alkoxyoxazol derivatives as PPAR agonists HOFFMANN LA ROCHE 2010-04-28 CN disclosed
EP-1572203-B1 SUBSTITUTED 4-ALKOXYOXAZOL DERIVATIVES AS PPAR AGONISTS HOFFMANN LA ROCHE (CH) 2007-11-07 EP disclosed
US-7109225-B2 Antidiabetic agents; hypotensive agents; anticholesterol agents; antilipemic agents; antiinflammatory agents; antiproliferative agents HOFMANN-LA ROCHE INC. (US) 2006-09-19 US disclosed
CN-1711084-A Substituted 4-alkoxyoxazol derivatives as PPAR agonists HOFFMANN LA ROCHE (CH) 2005-12-21 CN disclosed
EP-1572203-A1 SUBSTITUTED 4-ALKOXYOXAZOL DERIVATIVES AS PPAR AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2005-09-14 EP disclosed
US-20040157898-A1 Novel substituted oxazole derivatives F. HOFFMANN-LA ROCHE AG (CH) 2004-08-12 US disclosed
WO-2004041275-A1 SUBSTITUTED 4-ALKOXYOXAZOL DERIVATIVES AS PPAR AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2004-05-21 WO disclosed
US-5498621-A Oxazolidinedione hypoglycemic agents PFIZER INC. (US) 1996-03-12 US disclosed
EP-0428312-B1 Oxazolidinedione hypoglycemic agents PFIZER (US) 1994-12-28 EP disclosed
WO-1991007107-A1 OXAZOLIDINEDIONE HYPOGLYCEMIC AGENTS PFIZER INC. (US) 1991-05-30 WO disclosed
EP-0428312-A2 Oxazolidinedione hypoglycemic agents PFIZER INC. (US) 1991-05-22 EP 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-20040157898-A1 Novel substituted oxazole derivatives OXA1L, SLC5A1, GPR119 PPARG 400/4885PPARA 497/4885PPARD 251/4885

“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.