SCHEMBL3967728

SCHEMBL3967728

CCCCCCN(CCc1ccccc1)C(=O)COc1ccc(C[C@](CC)(OCC)C(=O)O)cc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.45
PPARA Q07869 7/20 0.45
PPARD Q03181 3/20 0.45
ALOX5 P09917 1/20 0.43
CA12 O43570 3/20 0.43
CA1 P00915 3/20 0.43
CA2 P00918 3/20 0.43
CA4 P22748 1/20 0.43
TRPM8 Q7Z2W7 2/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL3960798 0.92 TRPM8 (0.49) CA12CA1CA2CA4TRPM8
SCHEMBL3959652 0.85 BCHE (0.49) ALOX5TRPM8
SCHEMBL3966551 0.83 NPSR1 (0.40) PPARGPPARATRPM8
SCHEMBL5283269 0.83 FFAR1 (0.56) PPARGPPARAALOX5CA12CA1
SCHEMBL3963030 0.82 TRPM8 (0.64) TRPM8NPC1RAB9A
SCHEMBL3963118 0.81 PLA2G4A (0.44) PPARGPPARAPPARD
SCHEMBL3961314 0.81 BCHE (0.47) NPC1
SCHEMBL3963241 0.81 PPARA (0.46) PPARGPPARAPPARDTRPM8
SCHEMBL3964923 0.81 PPARA (0.46) PPARGPPARAPPARDTRPM8
SCHEMBL3965294 0.81 PPARA (0.46) PPARGPPARAPPARDTRPM8

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
US-7514471-B2 Substituted phenylpropionic acid derivatives as agonists to human peroxisome proliferator-activated receptor α (PPAR) ASTRAZENECA AB (SE) 2009-04-07 US disclosed
US-7488844-B2 Therapeutic agents ASTRAZENECA AB (SE) 2009-02-10 US disclosed
US-20050282822-A1 Therapeutic agents ASTRAZENECA AB (SE) 2005-12-22 US disclosed
US-20050171204-A1 Substituted phenylpropionic acid derivatives as agonists to human peroxisome proliferator-activated receptor alpha (ppar) ASTRAZENECA AB (SE) 2005-08-04 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-20050282822-A1 Therapeutic agents GPR119, LIPC, PNLIP PPARG 228/4885PPARA 346/4885PPARD 623/4885
US-20050171204-A1 Substituted phenylpropionic acid derivatives as agonists to human peroxisome proliferator-activated receptor alpha (ppar) PPARA, PPARD, PPARG PPARG 3/4885PPARA 1/4885PPARD 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.