SCHEMBL26582007

SCHEMBL26582007

N#Cc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1-c1ccc2ccccc2c1-c1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)ccc1C#N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ SLC22A12 Q96S37 2/20 0.39
▸ CYP11B1 P15538 2/20 0.39
▸ CYP11B2 P19099 2/20 0.39
▸ ALDH1A1 P00352 5/20 0.38
▸ LMNA P02545 4/20 0.38
▸ HTT P42858 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ CYP1A2 P05177 4/20 0.38
▸ CYP2C19 P33261 3/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ CLK4 Q9HAZ1 2/20 0.38
▸ CYP2C9 P11712 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ HSD17B10 Q99714 2/20 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
SCHEMBL26582009 0.93 FASN (0.40) KMT2AKDM4EMAPTMAPK1SLC22A12
SCHEMBL26582010 0.88 XDH (0.43) KMT2AKDM4EMAPTMAPK1SLC22A12
SCHEMBL22064797 0.85 ESR2 (0.40) KMT2AKDM4EMAPTMAPK1SLC22A12
SCHEMBL19939315 0.84 MAPT (0.41) KMT2AKDM4EMAPTMAPK1SLC22A12
SCHEMBL19939352 0.84 ESR2 (0.42) KMT2AKDM4EMAPTMAPK1SLC22A12
SCHEMBL21658225 0.84 SLC22A12 (0.46) KDM4ESLC22A12CYP11B1CYP11B2ALDH1A1
SCHEMBL22065338 0.84 SLC22A12 (0.48) KMT2AKDM4EMAPTMAPK1SLC22A12
SCHEMBL26581889 0.82 ALDH1A1 (0.46) KMT2AKDM4EMAPTCYP11B1CYP11B2
SCHEMBL21131655 0.81 MCL1 (0.36) KMT2AKDM4EMAPTMAPK1SLC22A12
SCHEMBL19939330 0.81 ESR2 (0.44) KMT2AKDM4EMAPTMAPK1SLC22A12

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-2023195735-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2023-10-12 — — WO disclosed
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