SCHEMBL25660749

SCHEMBL25660749

N#Cc1cc(C(F)(F)F)ccc1-c1cc(-n2c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc32)c(C#N)c(-n2c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc32)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
XDH P47989 2/20 0.37
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MAPT P10636 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CTSS P25774 2/20 0.34
CTSK P43235 1/20 0.34
LMNA P02545 2/20 0.34
CYP1A2 P05177 1/20 0.34
GAA P10253 1/20 0.34
CYP2D6 P10635 1/20 0.34
HPGD P15428 1/20 0.34
CYP2C19 P33261 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
ABCG2 Q9UNQ0 5/20 0.33
DPP4 P27487 1/20 0.31
HIF1A Q16665 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
SCHEMBL25660664 0.97 ALOX5AP (0.38) ALOX5APFEN1XDHALDH1A1SMN1; SMN2
SCHEMBL25660656 0.92 ALOX5AP (0.39) ALOX5APFEN1XDHALDH1A1SMN1; SMN2
SCHEMBL25660633 0.92 ALOX5AP (0.38) ALOX5APFEN1XDHALDH1A1SMN1; SMN2
SCHEMBL25660295 0.91 ALOX5AP (0.40) ALOX5APFEN1XDHALDH1A1SMN1; SMN2
SCHEMBL20111845 0.90 ALDH1A1 (0.36) ALOX5APFEN1ALDH1A1SMN1; SMN2MAPT
SCHEMBL25660748 0.89 ALOX5AP (0.39) ALOX5APFEN1XDHALDH1A1SMN1; SMN2
SCHEMBL25660631 0.89 ALOX5AP (0.39) ALOX5APFEN1XDHALDH1A1SMN1; SMN2
SCHEMBL25660779 0.88 ALOX5AP (0.38) ALOX5APFEN1XDHALDH1A1SMN1; SMN2
SCHEMBL26777546 0.88 ALOX5AP (0.38) ALOX5APFEN1XDHALDH1A1SMN1; SMN2
SCHEMBL25660626 0.88 ALOX5AP (0.36) ALOX5APFEN1XDHALDH1A1CTSS

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.