SCHEMBL25036143

SCHEMBL25036143

N#Cc1ccc(-c2cccc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5cccc6ccccc56)n4)c3)c2)cc1-c1cccc(-c2cc3c4c(cccc4c2)-c2ccccc2-3)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 2/20 0.38
▸ CYP11B2 P19099 2/20 0.38
▸ XDH P47989 1/20 0.37
▸ MCL1 Q07820 1/20 0.36
▸ PIM1 P11309 2/20 0.36
▸ ALDH1A1 P00352 5/20 0.35
▸ MAPK1 P28482 3/20 0.35
▸ KDM4E B2RXH2 3/20 0.35
▸ TSHR P16473 2/20 0.35
▸ HSD17B10 Q99714 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ NFKB1 P19838 1/20 0.35
▸ NFKB2 Q00653 1/20 0.35
▸ RELA Q04206 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL25036043 1.00 CYP11B1 (0.38) CYP11B1CYP11B2XDHMCL1PIM1
SCHEMBL25036057 0.90 MCL1 (0.37) CYP11B1CYP11B2XDHMCL1PIM1
SCHEMBL25038493 0.90 XDH (0.39) CYP11B1CYP11B2XDHMCL1PIM1
SCHEMBL25038496 0.89 CYP11B1 (0.38) CYP11B1CYP11B2ALDH1A1KDM4ETSHR
SCHEMBL25038633 0.89 XDH (0.43) CYP11B1CYP11B2XDHMCL1PIM1
SCHEMBL25038363 0.88 PIM1 (0.41) XDHMCL1PIM1ALDH1A1MAPK1
SCHEMBL25038877 0.88 CYP11B1 (0.36) CYP11B1CYP11B2XDHMCL1ALDH1A1
SCHEMBL25038444 0.88 PIM1 (0.41) XDHPIM1ALDH1A1MAPK1KDM4E
SCHEMBL25038349 0.88 MCL1 (0.36) CYP11B1CYP11B2XDHMCL1PIM1
SCHEMBL25038474 0.87 MCL1 (0.40) CYP11B1CYP11B2XDHMCL1PIM1

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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