SCHEMBL3959641

SCHEMBL3959641

CCCCN(Cc1ccc(OCc2ccccc2)cc1)C(=O)COc1ccc(C(CC)[C@H](OCC)C(=O)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.46
BCHE P06276 1/20 0.45
PPARA Q07869 2/20 0.44
PPARG P37231 1/20 0.44
PPARD Q03181 1/20 0.44
ALOX5 P09917 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TSPO P30536 1/20 0.42
LPAR1 Q92633 1/20 0.41
LPAR2 Q9HBW0 1/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
USP2 O75604 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL3960796 0.92 TRPM8 (0.48) TRPM8LPAR1LPAR2USP2HSD17B10
SCHEMBL3964005 0.87 FFAR1 (0.45) TRPM8PPARAPPARGPPARDLPAR1
SCHEMBL3963025 0.86 TRPM8 (0.63) TRPM8HSD17B10ALDH1A1LMNASMN1; SMN2
SCHEMBL3967726 0.84 ALOX5 (0.42) TRPM8PPARAPPARGPPARDALOX5
SCHEMBL3960947 0.83 PPARA (0.66) TRPM8BCHEPPARAPPARGPPARD
SCHEMBL3961372 0.81 FFAR1 (0.47) TRPM8ALDH1A1LMNASMN1; SMN2
SCHEMBL3963796 0.81 RAB9A (0.62) TRPM8L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL3959647 0.80 PPARA (0.55) TRPM8BCHEPPARAPPARGPPARD
SCHEMBL3963639 0.79 TRPM8 (0.51) TRPM8ALDH1A1
SCHEMBL3967930 0.79 POLB (0.46) BCHELPAR1USP2HSD17B10

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-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-20050148656-A1 3-(amino-oxo(alkyl, alkyloxy and alkylthio)phenyl) propanoic and propenoic acid derivatives; peroxisome proliferator-activated receptors agonists; dyslipidemias with or without insulin resisitance and associated metabolic disorders (metabolic syndrome) including obesity, hypertension, type 2 diabetes ASTRAZENECA AB (SE) 2005-07-07 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-20050148656-A1 3-(amino-oxo(alkyl, alkyloxy and alkylthio)phenyl) propanoic and propenoic acid derivatives; peroxisome proliferator-activated receptors agonists; dyslipidemias with or without insulin resisitance and associated metabolic disorders (metabolic syndrome) including obesity, hypertension, type 2 diabetes GPR119, PPARA, PPARG TRPM8 2338/4885BCHE 4358/4885PPARA 2/4885
US-20050282822-A1 Therapeutic agents GPR119, LIPC, PNLIP TRPM8 4071/4885BCHE 2688/4885PPARA 346/4885

“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.