SCHEMBL23968831

SCHEMBL23968831

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

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AR P10275 11/20 0.36
PGR P06401 2/20 0.36
CTSS P25774 2/20 0.33
CTSK P43235 2/20 0.33
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
MPL P40238 2/20 0.31
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31
KIF11 P52732 1/20 0.31
GRIN2B Q13224 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
SCHEMBL23968863 0.85 AR (0.40) ARPGRCTSSCTSK
SCHEMBL23968829 0.82
SCHEMBL23968959 0.81 AR (0.36) ARALOX5APFEN1
SCHEMBL23968865 0.78 KDM4E (0.32)
SCHEMBL23968844 0.77 TRPA1 (0.31) CTSSCTSK
SCHEMBL21917088 0.74 AR (0.34) ARPGRCTSSCTSKMPL
SCHEMBL20823387 0.72 CTSS (0.32) CTSSCTSKKIF11
SCHEMBL23969079 0.71 GRM5 (0.38) ALOX5APFEN1
SCHEMBL21370851 0.70 AR (0.32) ARPGRCTSSCTSK
SCHEMBL21252801 0.69 GPR3 (0.41) ALOX5APFEN1KIF11

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 AR 725/4885PGR 1154/4885CTSS 4077/4885

“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.