SCHEMBL12469535

SCHEMBL12469535

CC(=O)C(=O)Oc1cccc(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.50
PRSS1 P07477 1/20 0.50
ACR P10323 1/20 0.50
KDM4E B2RXH2 1/20 0.49
MAOB P27338 2/20 0.48
CES2 O00748 1/20 0.47
FAAH O00519 2/20 0.47
MAPT P10636 2/20 0.47
PPARG P37231 4/20 0.47
PPARA Q07869 1/20 0.47
MRGPRX4 Q96LA9 1/20 0.46
NPSR1 Q6W5P4 1/20 0.45
LMNA P02545 1/20 0.44

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
SCHEMBL11860150 0.90 PRSS1 (0.55) ATMPRSS1ACRKDM4EMAOB
SCHEMBL15836532 0.87 ATM (0.48) ATMPRSS1ACRKDM4EMAOB
SCHEMBL869141 0.86 CYP3A4 (0.58) ATMPRSS1ACRKDM4EMAOB
SCHEMBL10389716 0.85 CYP3A4 (0.47) ATMMAPTLMNA
SCHEMBL30116329 0.82 PRSS1 (0.55) ATMPRSS1ACRKDM4EMAOB
SCHEMBL9254070 0.82 ATM (0.48) ATMPRSS1ACRKDM4EMAOB
SCHEMBL11904756 0.82 PRSS1 (0.55) ATMPRSS1ACRKDM4EMAOB
SCHEMBL9575170 0.82 PRSS1 (0.49) ATMPRSS1ACRKDM4EMAOB
SCHEMBL11848431 0.81 PPARG (0.54) ATMPRSS1ACRKDM4ECES2
SCHEMBL18697300 0.81 PRSS1 (0.54) ATMPRSS1ACRKDM4EMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10174065-B2 Antidiabetic enolic glucoside of phenylpyruvic acid ZADEC APS (DK) 2019-01-08 US disclosed
US-20160083411-A1 ANTIDIABETIC ENOLIC GLUCOSIDE OF PHENYLPYRUVIC ACID ZADEC APS (DK) 2016-03-24 US disclosed
US-9221860-B2 Antidiabetic enolic glucoside of phenylpyruvic acid ZADEC APS (DK) 2015-12-29 US disclosed
EP-2625184-B1 ANTIDIABETIC ENOLIC GLUCOSIDE OF PHENYLPYRUVIC ACID ZADEC APS (DK) 2014-10-01 EP disclosed
US-20130310331-A1 ANTIDIABETIC ENOLIC GLUCOSIDE OF PHENYLPYRUVIC ACID ZADEC APS (DK) 2013-11-21 US disclosed
EP-2625184-A1 ANTIDIABETIC ENOLIC GLUCOSIDE OF PHENYLPYRUVIC ACID Zadec ApS (DK) 2013-08-14 EP disclosed
WO-2012045363-A1 ANTIDIABETIC ENOLIC GLUCOSIDE OF PHENYLPYRUVIC ACID ZADEC APS (DK) 2012-04-12 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 (3 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-10174065-B2 Antidiabetic enolic glucoside of phenylpyruvic acid PC, SLC5A1, SLC5A2 ATM 4147/4885PRSS1 1701/4885ACR 2423/4885
US-20160083411-A1 ANTIDIABETIC ENOLIC GLUCOSIDE OF PHENYLPYRUVIC ACID PC, SLC5A1, SLC5A2 ATM 4147/4885PRSS1 1701/4885ACR 2423/4885
US-20130310331-A1 ANTIDIABETIC ENOLIC GLUCOSIDE OF PHENYLPYRUVIC ACID PC, SLC5A1, SLC5A2 ATM 4147/4885PRSS1 1701/4885ACR 2423/4885

“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.