SCHEMBL23969073

SCHEMBL23969073

N#CC(C#N)=C1c2cc(OC(F)(F)F)c(-c3ccc(OC(F)(F)F)c(F)c3)cc2-c2cc(-c3ccc(OC(F)(F)F)c(F)c3)c(OC(F)(F)F)cc21

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.39
EPHX2 P34913 1/20 0.38
CTSK P43235 1/20 0.34
NAAA Q02083 1/20 0.34
FAAH O00519 1/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
ABL1 P00519 2/20 0.31
MGAT2 Q10469 1/20 0.31
SCN9A Q15858 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
GRM2 Q14416 1/20 0.30
FFAR1 O14842 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30

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
SCHEMBL12149395 0.90 PDE2A (0.39) PDE2AEPHX2CTSKNAAAFAAH
SCHEMBL23968855 0.90 PDE2A (0.34) PDE2AEPHX2ALOX5APFEN1
SCHEMBL21917431 0.89 CYP11B1 (0.38)
SCHEMBL21917433 0.89 PDE2A (0.36) PDE2AEPHX2CTSKNAAAFAAH
SCHEMBL23969028 0.89 PDE2A (0.36) PDE2AEPHX2CTSKNAAAFAAH
SCHEMBL23969017 0.88 KIF11 (0.30)
SCHEMBL23968957 0.87 PDE3B (0.37) ALDH1A1GAAMAPTPKMFFAR4
SCHEMBL23968920 0.87
SCHEMBL21917088 0.86 AR (0.34) CTSKSCN9A
SCHEMBL23968823 0.86 KIF11 (0.40) FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11165025-B2 Compound and organic electronic element comprising same LG CHEM, LTD. 2021-11-02 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 (1 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-11165025-B2 Compound and organic electronic element comprising same OR10J3, ESR1, ETV6 PDE2A 4667/4885EPHX2 97/4885CTSK 2897/4885

“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.