SCHEMBL25035999

SCHEMBL25035999

N#Cc1c(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5cc6ccccc6c6ccccc56)c4)n3)cc2)cccc1-c1ccccc1-c1ccc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 5/20 0.35
▸ ALDH1A1 P00352 5/20 0.35
▸ MEN1 O00255 5/20 0.35
▸ KMT2A Q03164 5/20 0.35
▸ CYP1A2 P05177 4/20 0.35
▸ CYP3A4 P08684 3/20 0.35
▸ CYP2C19 P33261 3/20 0.35
▸ CLK4 Q9HAZ1 3/20 0.35
▸ LMNA P02545 3/20 0.35
▸ TSHR P16473 3/20 0.35
▸ CYP2D6 P10635 2/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ SQOR Q9Y6N5 3/20 0.34
▸ CYP11B1 P15538 1/20 0.34
▸ PIM1 P11309 2/20 0.34
▸ MAPK1 P28482 4/20 0.33
▸ L3MBTL1 Q9Y468 3/20 0.33
▸ ADORA2A P29274 2/20 0.33
▸ ADORA1 P30542 2/20 0.33
▸ HIF1A Q16665 2/20 0.33

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
SCHEMBL25037962 0.91 HSD17B10 (0.36) HSD17B10ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL25036004 0.90 CYP11B1 (0.38) HSD17B10ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL25038383 0.89 PIM1 (0.41) HSD17B10ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL25037965 0.88 PIM1 (0.43) HSD17B10ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL25038440 0.88 MEN1 (0.42) HSD17B10ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL25037984 0.87 HSD17B10 (0.41) HSD17B10ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL25036005 0.87 PIM1 (0.43) HSD17B10ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL25038437 0.87 HSD17B10 (0.41) HSD17B10ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL25037970 0.87 HSD17B10 (0.41) HSD17B10ALDH1A1MEN1KMT2ACYP1A2
SCHEMBL25038454 0.87 PIM1 (0.43) HSD17B10ALDH1A1MEN1KMT2ACYP1A2

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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