SCHEMBL25038545

SCHEMBL25038545

N#Cc1cc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc5c6c(cccc46)-c4ccccc4-5)n3)cc2)ccc1-c1cccc(-c2cccc(-c3ccc4c(c3)-c3cccc5cccc-4c35)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 5/20 0.40
▸ LMNA P02545 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ THRB P10828 2/20 0.35
▸ HTT P42858 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ APAF1 O14727 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ XBP1 P17861 1/20 0.35
▸ PTBP1 P26599 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ GALK1 P51570 1/20 0.35
▸ BLM P54132 1/20 0.35
▸ SMAD3 P84022 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ MCL1 Q07820 1/20 0.34

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
SCHEMBL25038586 0.93 XDH (0.46) XDHLMNAMEN1THRBHTT
SCHEMBL25038481 0.92 XDH (0.40) XDHLMNAMEN1THRBHTT
SCHEMBL25038877 0.92 CYP11B1 (0.36) XDHLMNAMEN1THRBHTT
SCHEMBL25038538 0.91 XDH (0.41) XDHLMNAMEN1KMT2AMCL1
SCHEMBL25037879 0.91 XDH (0.46) XDHLMNAMEN1THRBHTT
SCHEMBL25038583 0.90 XDH (0.41) XDHLMNAMEN1THRBHTT
SCHEMBL25038620 0.90 XDH (0.42) XDHLMNAMEN1THRBHTT
SCHEMBL25038551 0.89 XDH (0.46) XDHL3MBTL1MAPTATMSMN1; SMN2
SCHEMBL25038622 0.89 XDH (0.46) XDHLMNAMEN1THRBHTT
SCHEMBL25038596 0.89 XDH (0.38) XDHLMNAMEN1THRBKMT2A

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-2023018267-A1 NOVEL COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2023-02-16 — — WO disclosed
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