SCHEMBL23969088

SCHEMBL23969088

N#CC(C#N)=C1c2cc(OC(F)(F)F)c(-c3cccc(C(F)(F)F)c3)cc2-c2cc(-c3cccc(C(F)(F)F)c3)c(OC(F)(F)F)cc21

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
DHODH Q02127 2/20 0.39
PTGDR2 Q9Y5Y4 2/20 0.38
CTSS P25774 1/20 0.38
SCN9A Q15858 1/20 0.37
AKR1C3 P42330 2/20 0.36
AKR1C2 P52895 2/20 0.36
RORB Q92753 3/20 0.35
RORC P51449 2/20 0.35
CTSK P43235 2/20 0.34
BACE1 P56817 1/20 0.34
KCNH2 Q12809 1/20 0.34
XDH P47989 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
NAAA Q02083 1/20 0.33

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
SCHEMBL23968853 0.87 KDM4E (0.36) KDM4EMAPTL3MBTL1PTGDR2AKR1C3
SCHEMBL23968958 0.86 PDK2 (0.34) KDM4EMAPTL3MBTL1DHODHSCN9A
SCHEMBL23968819 0.86 BACE1 (0.41) KDM4EMAPTL3MBTL1PTGDR2AKR1C3
SCHEMBL21917313 0.86 BACE1 (0.37) KDM4EMAPTL3MBTL1PTGDR2SCN9A
SCHEMBL21917696 0.85 RXRA (0.37) KDM4EMAPTL3MBTL1PTGDR2BACE1
SCHEMBL23968999 0.83 KDM4E (0.33) KDM4EMAPTL3MBTL1
SCHEMBL24487603 0.81 ABL1 (0.39) KDM4EMAPTL3MBTL1CTSSRORC
SCHEMBL23969104 0.81 XDH (0.43) KDM4EPTGDR2CTSSSCN9AAKR1C3
SCHEMBL21917306 0.81 XDH (0.43) KDM4EPTGDR2CTSSSCN9AAKR1C3
SCHEMBL12118000 0.81 CTSS (0.42) MAPTCTSSAKR1C3AKR1C2RORB

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 KDM4E 664/4885MAPT 1908/4885L3MBTL1 3225/4885

“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.