SCHEMBL24656708

SCHEMBL24656708

C1=CC(c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5oc6cc(-c7ccc8ccccc8c7)ccc6c45)c4ccccc34)n2)=CCC1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAPT P10636 1/20 0.30

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
SCHEMBL24972344 0.95 KDM4E (0.31) ALDH1A1KDM4EMEN1TP53CYP1A2
SCHEMBL24973744 0.94 HCRTR1 (0.32)
SCHEMBL26341695 0.94 KDM4E (0.33) ALDH1A1KDM4EMEN1TP53CYP1A2
SCHEMBL24972232 0.93 ALDH1A1 (0.34) ALDH1A1KDM4EMEN1TP53CYP1A2
SCHEMBL24972110 0.93 ALDH1A1 (0.32) ALDH1A1KDM4EMEN1TP53CYP1A2
SCHEMBL24658047 0.92 KDM4E (0.34) ALDH1A1KDM4ETP53SMN1; SMN2HSD17B10
SCHEMBL24314783 0.92 KDM4E (0.31) ALDH1A1KDM4EMEN1TP53CYP1A2
SCHEMBL23820331 0.92 PIM1 (0.32)
SCHEMBL26307223 0.91 KDM4E (0.32) ALDH1A1KDM4EMEN1TP53CYP1A2
SCHEMBL26337856 0.91 MMP12 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022177374-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2022-08-25 WO disclosed