SCHEMBL28523067

SCHEMBL28523067

Brc1ccc2c(c1)Sc1ccc(-c3cc(-c4ccccc4)cc(-c4ccccc4)n3)cc1S2

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 8/20 0.50
▸ AGTR1 P30556 1/20 0.43
▸ CYP19A1 P11511 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ MAPT P10636 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.38
▸ GABRA1 P14867 1/20 0.37
▸ GABRG2 P18507 1/20 0.37
▸ GABRB3 P28472 1/20 0.37
▸ GABRA5 P31644 1/20 0.37
▸ GABRA3 P34903 1/20 0.37
▸ ACHE P22303 1/20 0.36

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
SCHEMBL29949643 1.00 MCL1 (0.50) MCL1AGTR1CYP19A1ALDH1A1MEN1
SCHEMBL28521874 0.88 MEN1 (0.49) MCL1AGTR1ALDH1A1MEN1KMT2A
SCHEMBL29949441 0.88 MEN1 (0.49) MCL1AGTR1ALDH1A1MEN1KMT2A
SCHEMBL29949443 0.85 ALDH1A1 (0.43) MCL1AGTR1ALDH1A1MEN1KMT2A
SCHEMBL28525478 0.85 ALDH1A1 (0.43) MCL1AGTR1ALDH1A1MEN1KMT2A
SCHEMBL28521784 0.84 ALDH1A1 (0.52) MCL1AGTR1CYP19A1ALDH1A1MEN1
SCHEMBL29949667 0.81 ALDH1A1 (0.48) MCL1CYP19A1ALDH1A1MEN1KMT2A
SCHEMBL28518065 0.81 ALDH1A1 (0.48) MCL1CYP19A1ALDH1A1MEN1KMT2A
SCHEMBL11969753 0.81 MCL1 (0.70) MCL1AGTR1CYP19A1ALDH1A1MEN1
SCHEMBL19091436 0.81 MCL1 (0.70) MCL1AGTR1CYP19A1ALDH1A1MEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112358473-B Heteroanthracene derivative and application thereof and organic electroluminescent device 武汉尚赛光电科技有限公司 2022-09-27 — — CN disclosed
CN-112358473-A Heteroanthracene derivative, application thereof and organic electroluminescent device 武汉尚赛光电科技有限公司 2021-02-12 — — CN disclosed
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