SCHEMBL25036113

SCHEMBL25036113

N#Cc1ccc(-c2ccccc2-c2cc3ccccc3c3ccccc23)cc1-c1cccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccccc4-c4ccccc4)n3)c2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 2/20 0.37
▸ CYP11B2 P19099 2/20 0.37
▸ ALDH1A1 P00352 6/20 0.36
▸ LMNA P02545 3/20 0.36
▸ THRB P10828 1/20 0.36
▸ CYP1A2 P05177 4/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ TSHR P16473 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ HSD17B10 Q99714 3/20 0.35
▸ CYP3A4 P08684 3/20 0.35
▸ CYP2C19 P33261 2/20 0.35
▸ CLK4 Q9HAZ1 2/20 0.35
▸ CYP2C9 P11712 2/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ ABCG2 Q9UNQ0 4/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ NCOA3 Q9Y6Q9 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
SCHEMBL25038455 0.96 CYP11B1 (0.38) CYP11B1CYP11B2ALDH1A1LMNATHRB
SCHEMBL25038879 0.93 CYP11B1 (0.37) CYP11B1CYP11B2ALDH1A1LMNATHRB
SCHEMBL25038882 0.92 ALDH1A1 (0.38) CYP11B1CYP11B2ALDH1A1LMNATHRB
SCHEMBL25038459 0.92 ALDH1A1 (0.37) CYP11B1CYP11B2ALDH1A1LMNATHRB
SCHEMBL25036121 0.92 ALDH1A1 (0.36) CYP11B1CYP11B2ALDH1A1LMNATHRB
SCHEMBL25038470 0.92 PIM1 (0.37) CYP11B1CYP11B2ALDH1A1LMNATHRB
SCHEMBL25038472 0.91 ALDH1A1 (0.39) CYP11B1CYP11B2ALDH1A1LMNATHRB
SCHEMBL25038421 0.91 ALDH1A1 (0.38) CYP11B1CYP11B2ALDH1A1LMNATHRB
SCHEMBL25038640 0.89 XDH (0.40) CYP11B1CYP11B2ALDH1A1LMNATHRB
SCHEMBL26553201 0.89 CYP11B1 (0.42) CYP11B1CYP11B2ALDH1A1LMNATHRB

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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