SCHEMBL27414564

SCHEMBL27414564

N#Cc1c(C(F)(F)F)cc(C(F)(F)F)c(C#N)c1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 14/20 0.46
KDM4E B2RXH2 14/20 0.46
GAA P10253 12/20 0.46
HPGD P15428 10/20 0.46
GLA P06280 8/20 0.46
TP53 P04637 1/20 0.46
POLB P06746 2/20 0.41
HSD17B10 Q99714 1/20 0.41
KMT2A Q03164 5/20 0.39
HTT P42858 4/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 4/20 0.38
LMNA P02545 3/20 0.38
NCOA1 Q15788 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HIF1A Q16665 1/20 0.38
NCOA3 Q9Y6Q9 1/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
XBP1 P17861 1/20 0.38

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
SCHEMBL3118151 0.82 ALDH1A1 (0.46) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL25983363 0.79 KDM4E (0.47) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL27414569 0.77 ALDH1A1 (0.46) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL27319871 0.75 AR (0.42)
SCHEMBL7920588 0.75 KIF11 (0.42) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL12144648 0.75 ALDH1A1 (0.41) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL7576571 0.75 ALDH1A1 (0.41) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL7570304 0.74 ALDH1A1 (0.47) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL25983339 0.74 ALDH1A1 (0.43) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL1438722 0.74 KDM4E (0.47) ALDH1A1KDM4EGAAHPGDGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4728839-A1 ORGANIC COMPOUND OF FORMULA (I) FOR USE IN ORGANIC ELECTRONIC DEVICES, A COMPOSITION COMPRISING A COMPOUND OF FORMULA (IV) AND AT LEAST ONE COMPOUND OF FORMULA (IVA) TO (IVD), AN ORGANIC SEMICONDUCTOR LAYER COMPRISING THE COMPOUND OR COMPOSITION, AN ORGANIC ELECTRONIC DEVICE COMPRISING THE ORGANIC SEMICONDUCTOR LAYER, AND A DISPLAY DEVICE COMPRISING THE ORGANIC ELECTRONIC DEVICE Novaled GmbH (DE) 2026-04-22 EP disclosed
EP-4635276-A1 ORGANIC ELECTRONIC DEVICE AND DISPLAY DEVICE COMPRISING A COMPOUND OF FORMULA (I) AS WELL AS COMPOUNDS OF FORMULA (IA) Novaled GmbH (DE) 2025-10-22 EP disclosed
WO-2024260948-A1 ORGANIC COMPOUND OF FORMULA (I) FOR USE IN ORGANIC ELECTRONIC DEVICES, A COMPOSITION COMPRISING A COMPOUND OF FORMULA (IV) AND AT LEAST ONE COMPOUND OF FORMULA (IVA) TO (IVD), AN ORGANIC SEMICONDUCTOR LAYER COMPRISING THE COMPOUND OR COMPOSITION, AN ORGANIC ELECTRONIC DEVICE COMPRISING THE ORGANIC SEMICONDUCTOR LAYER, AND A DISPLAY DEVICE COMPRISING THE ORGANIC ELECTRONIC DEVICE NOVALED GMBH (DE) 2024-12-26 WO disclosed
WO-2024125834-A1 ORGANIC ELECTRONIC DEVICE AND DISPLAY DEVICE COMPRISING A COMPOUND OF FORMULA (I) AS WELL AS COMPOUNDS OF FORMULA (IA) NOVALED GMBH (DE) 2024-06-20 WO disclosed
WO-2024125834-A1 ORGANIC ELECTRONIC DEVICE AND DISPLAY DEVICE COMPRISING A COMPOUND OF FORMULA (I) AS WELL AS COMPOUNDS OF FORMULA (IA) NOVALED GMBH (DE) 2024-06-20 WO disclosed