SCHEMBL4692597

SCHEMBL4692597

CCOC(=O)c1cc(-c2ccc(C(C)(C)C)cc2)n(CC)n1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.57
PPARG P37231 5/20 0.54
PPARA Q07869 4/20 0.54
NR1H2 P55055 2/20 0.50
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
MAPT P10636 2/20 0.47
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
GAA P10253 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
CA9 Q16790 2/20 0.46
MARS1 P56192 1/20 0.45
CHRNA7 P36544 2/20 0.44
PPARD Q03181 1/20 0.43
POLB P06746 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
SCHEMBL4692571 0.87 PPARG (0.57) FAAHPPARGPPARANR1H2CYP2C9
SCHEMBL4688177 0.87 PPARG (0.56) FAAHPPARGPPARANR1H2CYP2C9
SCHEMBL4689578 0.87 PPARG (0.57) FAAHPPARGPPARANR1H2MAPT
SCHEMBL4693346 0.86 FAAH (0.56) FAAHPPARGPPARANR1H2CYP2C9
SCHEMBL21607519 0.85 FAAH (0.59) FAAHNR1H2MAPTMEN1NPC1
SCHEMBL14288144 0.84 FAAH (0.58) FAAHNR1H2MAPTGAAKMT2A
SCHEMBL4692489 0.84 MARS1 (0.60) PPARGPPARANPC1RAB9AMARS1
SCHEMBL17595004 0.79 CYP1A2 (0.53) CYP2C9CYP2C19MAPTMEN1NPC1
SCHEMBL4688975 0.78 SMN1; SMN2 (0.58) FAAHPPARGPPARACYP2C9CYP2C19
SCHEMBL17259268 0.77 MAPT (0.47) FAAHNR1H2MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1685113-B1 SUBSTITUTED PYRAZOLES AS PPAR AGONISTS SMITHKLINE BEECHAM CORP (US) 2008-07-30 EP disclosed
US-20080021030-A1 Substituted Pyrazoles As Ppar Agonists SMITHKLINE BEECHAM CORPORATION 2008-01-24 US disclosed
US-20080021030-A1 Substituted Pyrazoles As Ppar Agonists SMITHKLINE BEECHAM CORPORATION 2008-01-24 US disclosed
US-20080021030-A1 Substituted Pyrazoles As Ppar Agonists SMITHKLINE BEECHAM CORPORATION 2008-01-24 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-20080021030-A1 Substituted Pyrazoles As Ppar Agonists PPARD, PPARA, PPARG FAAH 274/4885PPARG 3/4885PPARA 2/4885

“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.