SCHEMBL25036006

SCHEMBL25036006

N#Cc1c(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccc5c6c(cccc46)-c4ccccc4-5)n3)c2)cccc1-c1cccc(-c2cccc3c2ccc2ccccc23)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 3/20 0.37
▸ HSD17B10 Q99714 6/20 0.36
▸ ALDH1A1 P00352 6/20 0.36
▸ TSHR P16473 4/20 0.36
▸ MAPK1 P28482 4/20 0.36
▸ HPGD P15428 3/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ HIF1A Q16665 2/20 0.36
▸ CASP1 P29466 1/20 0.36
▸ CYP1A2 P05177 5/20 0.35
▸ MEN1 O00255 5/20 0.35
▸ KMT2A Q03164 5/20 0.35
▸ CYP2C19 P33261 4/20 0.35
▸ LMNA P02545 4/20 0.35
▸ CYP3A4 P08684 3/20 0.35
▸ CLK4 Q9HAZ1 3/20 0.35
▸ CYP2D6 P10635 2/20 0.35
▸ CYP2C9 P11712 2/20 0.35
▸ ANPEP P15144 1/20 0.35
▸ KDM4E B2RXH2 3/20 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
SCHEMBL25037932 0.96 PIM1 (0.38) PIM1HSD17B10ALDH1A1TSHRMAPK1
SCHEMBL25037964 0.91 PIM1 (0.40) PIM1HSD17B10ALDH1A1TSHRMAPK1
SCHEMBL25037944 0.89 CYP1A2 (0.41) HSD17B10ALDH1A1TSHRMAPK1HPGD
SCHEMBL25036000 0.89 PIM1 (0.41) PIM1HSD17B10ALDH1A1TSHRMAPK1
SCHEMBL25037970 0.88 HSD17B10 (0.41) PIM1HSD17B10ALDH1A1TSHRMAPK1
SCHEMBL25037984 0.88 HSD17B10 (0.41) PIM1HSD17B10ALDH1A1TSHRMAPK1
SCHEMBL25036001 0.88 HSD17B10 (0.43) PIM1HSD17B10ALDH1A1TSHRMAPK1
SCHEMBL25038359 0.88 PIM1 (0.41) PIM1HSD17B10ALDH1A1TSHRMAPK1
SCHEMBL25038430 0.87 ALDH1A1 (0.40) PIM1HSD17B10ALDH1A1TSHRMAPK1
SCHEMBL25774839 0.86 ALDH1A1 (0.44) PIM1HSD17B10ALDH1A1TSHRMAPK1

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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