SCHEMBL25660985

SCHEMBL25660985

N#Cc1cc(C(F)(F)F)ccc1-c1cc(-n2c3ccccc3c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc32)c(-n2c3ccccc3c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc32)cc1C#N

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.37
FEN1 P39748 1/20 0.37
XDH P47989 2/20 0.35
ABCG2 Q9UNQ0 6/20 0.34
KIF11 P52732 1/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33
CNR2 P34972 1/20 0.33
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
TRPA1 O75762 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
SCN9A Q15858 1/20 0.32

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
SCHEMBL25660748 0.97 ALOX5AP (0.39) ALOX5APFEN1XDHABCG2PSEN1
SCHEMBL25659756 0.96 ALOX5AP (0.37) ALOX5APFEN1XDHABCG2KIF11
SCHEMBL25660984 0.94 ALOX5AP (0.37) ALOX5APFEN1XDHABCG2KIF11
SCHEMBL25660779 0.94 ALOX5AP (0.38) ALOX5APFEN1XDHABCG2PSEN1
SCHEMBL20111573 0.94 TRPA1 (0.36) ALOX5APFEN1XDHABCG2KIF11
SCHEMBL26777404 0.91 ALOX5AP (0.37) ALOX5APFEN1XDHABCG2KIF11
SCHEMBL25660986 0.91 ALOX5AP (0.39) ALOX5APFEN1XDHABCG2CTSS
SCHEMBL20112068 0.90 ABCG2 (0.37) ALOX5APFEN1XDHABCG2CTSS
SCHEMBL21108808 0.90 ABCG2 (0.38) ALOX5APFEN1XDHABCG2KIF11
SCHEMBL25660664 0.90 ALOX5AP (0.38) ALOX5APFEN1XDHABCG2KIF11

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-11825743-B2 Organic molecules for use in organic optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2023-11-21 US disclosed
EP-3585777-B1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO LTD (KR) 2023-05-10 EP 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-11825743-B2 Organic molecules for use in organic optoelectronic devices OR10J3, OR51E2, OCIAD2 ALOX5AP 3126/4885FEN1 1566/4885XDH 306/4885

“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.