SCHEMBL5065685

SCHEMBL5065685

CC(C)C(=O)N1C(=O)OC[C@@H]1Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.49
IL6ST P40189 1/20 0.48
NAAA Q02083 1/20 0.45
IDH1 O75874 8/20 0.44
FAAH O00519 1/20 0.43
ABCB1 P08183 1/20 0.39
AGTR2 P50052 1/20 0.39
CSNK2B P67870 1/20 0.39
CSNK2A1 P68400 1/20 0.39
HDAC1 Q13547 1/20 0.39

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
SCHEMBL21153769 1.00 PPARA (0.49) PPARAIL6STNAAAIDH1FAAH
SCHEMBL5065686 1.00 PPARA (0.49) PPARAIL6STNAAAIDH1FAAH
SCHEMBL15873519 0.90 PPARA (0.48) PPARAIL6STNAAAIDH1FAAH
SCHEMBL21113600 0.90 PPARA (0.48) PPARAIL6STNAAAIDH1FAAH
SCHEMBL9554132 0.90 PPARA (0.48) PPARAIL6STNAAAIDH1FAAH
SCHEMBL24418522 0.90 IL6ST (0.52) PPARAIL6STNAAAIDH1FAAH
SCHEMBL7406075 0.88 PPARA (0.47) PPARAIL6STNAAAIDH1FAAH
SCHEMBL2206996 0.88 PPARA (0.47) PPARAIL6STNAAAIDH1FAAH
SCHEMBL13316517 0.88 PPARA (0.54) PPARAIL6STNAAAIDH1FAAH
SCHEMBL14314072 0.88 PPARA (0.54) PPARAIL6STNAAAIDH1FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10611739-B2 Process for preparation of lactone derivatives and intermediates thereof PHARMARESOURCES (SHANGHAI) CO., LTD. (CN) 2020-04-07 US disclosed
US-20190210981-A1 PROCESS FOR PREPARATION OF LACTONE DERIVATIVES AND INTERMEDIATES THEREOF PHARMARESOURCES (SHANGHAI) CO., LTD. (CN) 2019-07-11 US disclosed
US-20080318838-A1 PEPTIDES BAUER WILFRIED 2008-12-25 US disclosed
US-20050009147-A1 Peptides BAUER WILFRIED (CH) 2005-01-13 US disclosed
EP-0672057-A1 ANALOGS OF PTH Novartis AG (CH) 1995-09-20 EP disclosed
WO-1994002510-A2 ANALOGS OF PTH SANDOZ LTD. (CH) 1994-02-03 WO 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 (4 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-10611739-B2 Process for preparation of lactone derivatives and intermediates thereof LSS, CYP3A4, HCCS PPARA 1136/4885IL6ST 2061/4885NAAA 2781/4885
US-20080318838-A1 PEPTIDES PTMS, PTH1R, CALCRL PPARA 1853/4885IL6ST 575/4885NAAA 602/4885
US-20190210981-A1 PROCESS FOR PREPARATION OF LACTONE DERIVATIVES AND INTERMEDIATES THEREOF LSS, CYP3A4, HCCS PPARA 1136/4885IL6ST 2061/4885NAAA 2781/4885
US-20050009147-A1 Peptides PTMS, PTH1R, CALCRL PPARA 1853/4885IL6ST 575/4885NAAA 602/4885

“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.