SCHEMBL1255839

SCHEMBL1255839

O=C(O)C=CC(=O)OC(F)C(F)F

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 11/20 0.56
TSHR P16473 2/20 0.41
TP53 P04637 1/20 0.41
EGLN1 Q9GZT9 1/20 0.41
EGLN3 Q9H6Z9 1/20 0.41
ALDH1A1 P00352 4/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GAA P10253 1/20 0.31
ATM Q13315 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
SCHEMBL27713816 1.00 HCAR2 (0.56) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL21178373 0.91 HCAR2 (0.41) HCAR2
SCHEMBL9238752 0.91 HCAR2 (0.41) HCAR2
SCHEMBL21178173 0.91 HCAR2 (0.41) HCAR2
SCHEMBL9242314 0.80 HCAR2 (0.56) HCAR2TP53ALDH1A1KDM4EMAPT
SCHEMBL9241506 0.80 HCAR2 (0.59) HCAR2TSHRKDM4EMAPT
SCHEMBL9243024 0.76 HCAR2 (0.38) HCAR2
SCHEMBL9576162 0.75 HCAR2 (0.35) HCAR2
SCHEMBL9240699 0.75 HCAR2 (0.53) HCAR2ALDH1A1MAPTATM
SCHEMBL17512887 0.74 HCAR2 (0.52) HCAR2TSHRTP53EGLN1EGLN3

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-9722240-B2 Electrode materials derived from polyquinonic ionic compounds and their use in electrochemical generators ACEP INC. (CA) 2017-08-01 US disclosed
US-7879492-B2 redox system; lithium batteries; nontoxic; improved electroconductivity ACEP INC. (CA) 2011-02-01 US disclosed
US-20100237298-A1 NEW ELECTRODE MATERIALS DERIVED FROM POLYQUINONIC IONIC COMPOUNDS AND THEIR USE IN ELECTROCHEMICAL GENERATORS ARMAND MICHEL 2010-09-23 US disclosed
US-20040202930-A1 New electrode materials derived from polyquinonic ionic compounds and their use in electrochemical generators NATIONAL SCIENCE FOUNDATION 2004-10-14 US disclosed
US-6743877-B1 ANIONIC REDOX MATERIALS; HIGHLY HETEROCONJUGATED SYSTEMS ACEP INC (CA) 2004-06-01 US disclosed
US-20030118877-A1 New electrode materials derived from polyquinonic ionic compounds and their use in electrochemical generators ARMAND MICHEL (CA) 2003-06-26 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-20040202930-A1 New electrode materials derived from polyquinonic ionic compounds and their use in electrochemical generators HTT, ATXN10, ATXN2 HCAR2 3793/4885TSHR 4457/4885TP53 4186/4885
US-20100237298-A1 NEW ELECTRODE MATERIALS DERIVED FROM POLYQUINONIC IONIC COMPOUNDS AND THEIR USE IN ELECTROCHEMICAL GENERATORS HTT, ATXN10, ATXN2 HCAR2 3793/4885TSHR 4457/4885TP53 4186/4885

“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.