SCHEMBL25565211

SCHEMBL25565211

Cc1nc(-c2ccc(-c3cc(-c4ccc(OC(F)(F)F)cc4)cc(-c4ccc(OC(F)(F)F)cc4)c3)cc2)nc(C)c1C

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.48
CHRNA7 P36544 8/20 0.47
AURKA O14965 1/20 0.44
TPX2 Q9ULW0 1/20 0.44
SCN5A Q14524 3/20 0.43
TDP2 O95551 1/20 0.42
SCN10A Q9Y5Y9 2/20 0.42
KIF11 P52732 1/20 0.41
PPARD Q03181 1/20 0.41
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
FPR2 P25090 1/20 0.40
SCN9A Q15858 1/20 0.40

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
SCHEMBL21389034 0.81 CHRNA7 (0.41) ADORA3CHRNA7AURKATPX2SCN5A
SCHEMBL7005915 0.75 ABCG2 (0.54) ADORA3CHRNA7KDM4EMAPT
SCHEMBL7011714 0.74 ADRB3 (0.41) ADORA3CHRNA7TDP2SCN10APPARD
SCHEMBL22461212 0.74 AURKA (0.44) ADORA3CHRNA7AURKATPX2SCN5A
SCHEMBL21389027 0.73 ESR1 (0.54) MAPT
SCHEMBL9060680 0.72 SCN5A (0.48) ADORA3CHRNA7SCN5ATDP2SCN10A
SCHEMBL17110105 0.72 KIF11 (0.53) AURKATPX2SCN5ASCN10AKIF11
SCHEMBL1044896 0.72 KIF11 (0.53) AURKATPX2SCN5ASCN10AKIF11
SCHEMBL7708933 0.71 AURKA (0.46) ADORA3AURKATPX2SCN5AKIF11
SCHEMBL27675967 0.71 CHRNA7 (0.62) ADORA3CHRNA7KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11678574-B2 Compound and organic light emitting diode comprising same LG CHEM, LTD. (KR) 2023-06-13 US disclosed
US-11678574-B2 Compound and organic light emitting diode comprising same LG CHEM, LTD. (KR) 2023-06-13 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-11678574-B2 Compound and organic light emitting diode comprising same CYP1A1, ARL1, ALDH1A1 ADORA3 1587/4885CHRNA7 3323/4885AURKA 1215/4885

“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.