SCHEMBL25660958

SCHEMBL25660958

N#Cc1cc(C#N)cc(-c2ccc3c4ccc(-c5cc(C#N)cc(C#N)c5)cc4n(-c4cc(C#N)c(-c5ccc(C(F)(F)F)cc5C#N)cc4-n4c5cc(-c6cc(C#N)cc(C#N)c6)ccc5c5ccc(-c6cc(C#N)cc(C#N)c6)cc54)c3c2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.39
FEN1 P39748 1/20 0.39
RXRA P19793 1/20 0.36
RXRG P48443 1/20 0.36
KIF11 P52732 2/20 0.36
SCN9A Q15858 1/20 0.34
DGAT1 O75907 1/20 0.33
SOAT1 P35610 1/20 0.33
KCNH2 Q12809 1/20 0.33
XDH P47989 2/20 0.33
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.32
GABRA1 P14867 2/20 0.31
GABRG2 P18507 2/20 0.31
GABRB3 P28472 2/20 0.31
GABRA2 P47869 2/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31

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
SCHEMBL25660959 0.95 KIF11 (0.36) ALOX5APFEN1RXRARXRGKIF11
SCHEMBL20112006 0.93 ALOX5AP (0.35) ALOX5APFEN1RXRARXRGKIF11
SCHEMBL25660932 0.92 KIF11 (0.46) ALOX5APFEN1RXRARXRGKIF11
SCHEMBL25659741 0.90 KIF11 (0.36) ALOX5APFEN1RXRARXRGKIF11
SCHEMBL25660950 0.89 ALOX5AP (0.43) ALOX5APFEN1KIF11SCN9ADGAT1
SCHEMBL20617110 0.89 RXRA (0.42) ALOX5APFEN1RXRARXRGKIF11
SCHEMBL20112011 0.88 TRPA1 (0.35) ALOX5APFEN1RXRARXRGKIF11
SCHEMBL20925053 0.88 RXRA (0.41) ALOX5APFEN1RXRARXRGKIF11
SCHEMBL25660929 0.88 KIF11 (0.41) ALOX5APFEN1KIF11SCN9ADGAT1
SCHEMBL25660628 0.87 ALOX5AP (0.39) ALOX5APFEN1RXRARXRGKIF11

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 1566/4885RXRA 1937/4885

“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.