SCHEMBL29625601

SCHEMBL29625601

Brc1c(N(c2ccccc2)c2cccc3ccccc23)cccc1-n1c2ccccc2c2ccc3ccccc3c21

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 4/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ ATM Q13315 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL29625613 0.91 ALDH1A1 (0.37) SIGMAR1TDP1ALDH1A1KDM4EATM
SCHEMBL29625609 0.90 SIGMAR1 (0.32) SIGMAR1TDP1
SCHEMBL29625629 0.85 SIGMAR1 (0.33) SIGMAR1ALDH1A1
SCHEMBL29625607 0.85 SIGMAR1 (0.33) SIGMAR1TDP1ALDH1A1
SCHEMBL29625617 0.85 PER2 (0.32) TDP1
SCHEMBL24374155 0.82 TDP1 (0.37) TDP1ALDH1A1KDM4EATML3MBTL1
SCHEMBL25847027 0.82 ALDH1A1 (0.41) ALDH1A1KDM4EATML3MBTL1
SCHEMBL29625581 0.82 TDP1 (0.42) SIGMAR1TDP1ALDH1A1KDM4EATM
SCHEMBL24374471 0.81 TDP1 (0.38) TDP1ALDH1A1KDM4EATML3MBTL1
SCHEMBL29625583 0.80 TDP1 (0.41) SIGMAR1TDP1ALDH1A1KDM4EATM

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-2022131780-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME 솔루스첨단소재 주식회사 2022-06-23 — — WO disclosed
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