SCHEMBL4929643

SCHEMBL4929643

CCc1oc(-c2ccc3ccccc3c2)nc1C(OC)C1CCCC(COC(C)(C)C(=O)O)C1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.35
PPARA Q07869 6/20 0.35
PPARD Q03181 3/20 0.35
SLC16A3 O15427 4/20 0.33
SLC16A1 P53985 4/20 0.33
MCTS1 Q9ULC4 2/20 0.32
MAPT P10636 3/20 0.32
RXFP1 Q9HBX9 1/20 0.32
UTRN P46939 3/20 0.31
SLC6A3 Q01959 3/20 0.31
SLC6A4 P31645 2/20 0.31
TP53 P04637 1/20 0.31
THRB P10828 1/20 0.31

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
SCHEMBL4929653 1.00 PPARG (0.35) PPARGPPARAPPARDSLC16A3SLC16A1
SCHEMBL4377288 0.94 PPARG (0.37) PPARGPPARAPPARDSLC16A3SLC16A1
SCHEMBL4375526 0.85 PPARG (0.35) PPARGPPARAPPARDSLC16A3SLC16A1
SCHEMBL4391942 0.85 PPARG (0.35) PPARGPPARAPPARDSLC16A3SLC16A1
SCHEMBL4382592 0.85 PPARA (0.34) PPARGPPARAPPARD
SCHEMBL4388895 0.85 PPARA (0.34) PPARGPPARAPPARD
SCHEMBL4391936 0.83 PPARG (0.33) PPARGPPARAPPARD
SCHEMBL4375516 0.82 PPARA (0.39) PPARGPPARAPPARDMAPTTP53
SCHEMBL4384708 0.81 PPARA (0.42) PPARGPPARAPPARDSLC16A3SLC16A1
SCHEMBL4382001 0.81 PPARA (0.42) PPARGPPARAPPARDSLC16A3SLC16A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080015238-A1 CYCLOALKYLMETHOXY-SUBSTITUTED ACETIC ACID DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-01-17 US disclosed
US-7259177-B2 Cycloalkylmethoxy-substituted acetic acid derivatives, processes for their preparation and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-08-21 US disclosed
US-20050101637-A1 Cycloalkylmethoxy-substituted acetic acid derivatives, processes for their preparation and their use as pharmaceuticals AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-05-12 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 (2 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-20080015238-A1 CYCLOALKYLMETHOXY-SUBSTITUTED ACETIC ACID DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS GPR119, PC, ACADM PPARG 80/4885PPARA 122/4885PPARD 132/4885
US-20050101637-A1 Cycloalkylmethoxy-substituted acetic acid derivatives, processes for their preparation and their use as pharmaceuticals GPR119, PC, CPT1A PPARG 99/4885PPARA 132/4885PPARD 145/4885

“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.