SCHEMBL25038481

SCHEMBL25038481

N#Cc1cc(-c2cccc(-c3ccc4c(c3)-c3cccc5cccc-4c35)c2)ccc1-c1cccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccccc4)c3)n2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 6/20 0.40
▸ LMNA P02545 2/20 0.38
▸ THRB P10828 2/20 0.38
▸ HTT P42858 2/20 0.38
▸ ATM Q13315 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ APAF1 O14727 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ XBP1 P17861 1/20 0.38
▸ PTBP1 P26599 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ GALK1 P51570 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ SMAD3 P84022 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ CYP11B1 P15538 1/20 0.37

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
SCHEMBL25038583 0.98 XDH (0.41) XDHLMNATHRBHTTATM
SCHEMBL25038620 0.98 XDH (0.42) XDHLMNATHRBHTTATM
SCHEMBL25038642 0.93 XDH (0.40) XDHLMNATHRBHTTATM
SCHEMBL25038570 0.93 XDH (0.40) XDHLMNATHRBHTTATM
SCHEMBL25038603 0.93 XDH (0.38) XDHHTTMEN1KMT2ASMN1; SMN2
SCHEMBL25038466 0.93 CYP11B1 (0.40) XDHLMNATHRBHTTATM
SCHEMBL26581948 0.93 XDH (0.43) XDHLMNATHRBHTTATM
SCHEMBL25038545 0.92 XDH (0.40) XDHLMNATHRBHTTATM
SCHEMBL25038586 0.91 XDH (0.46) XDHLMNATHRBHTTATM
SCHEMBL25038542 0.91 XDH (0.39) XDHLMNATHRBL3MBTL1MEN1

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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