SCHEMBL23969068

SCHEMBL23969068

N#Cc1cc2c(cc1-c1ccc(OC(F)(F)F)cc1)-c1cc(-c3ccc(OC(F)(F)F)cc3)c(C#N)cc1C2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.39
MAOB P27338 1/20 0.39
SCN9A Q15858 2/20 0.37
TRPA1 O75762 2/20 0.37
SCN5A Q14524 1/20 0.37
AR P10275 2/20 0.37
PGR P06401 1/20 0.37
KDM5A P29375 1/20 0.35
KIF11 P52732 1/20 0.35
NISCH Q9Y2I1 1/20 0.35
ADORA1 P30542 1/20 0.35
XDH P47989 1/20 0.35
CHEK1 O14757 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL23969069 0.81 NAAA (0.36) KDM1AARPGRXDH
SCHEMBL23968837 0.80 USP8 (0.44) KDM1AMAOBSCN9ATRPA1SCN5A
SCHEMBL23969051 0.80 ALDH1A1 (0.38) KDM1AMAOBSCN9ATRPA1SCN5A
SCHEMBL21917294 0.80 ALDH1A1 (0.38) KDM1AMAOBSCN9ATRPA1SCN5A
SCHEMBL23968913 0.79 ALDH1A1 (0.37) KDM1AMAOBSCN9ATRPA1SCN5A
SCHEMBL20329163 0.75 STS (0.44) KDM1AMAOBSCN9ATRPA1SCN5A
SCHEMBL21917666 0.75 ALDH1A1 (0.41) MAOBADORA1MEN1ALDH1A1MAPT
SCHEMBL23968833 0.72 KCNJ1 (0.40) ARPGRCHEK1
SCHEMBL134890 0.71 KDM5A (0.37) KDM1AMAOBSCN9ATRPA1SCN5A
SCHEMBL12953430 0.70 CYP11B1 (0.51) ARPGRKIF11

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 KDM1A 1227/4885MAOB 1139/4885SCN9A 1458/4885

“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.