SCHEMBL12495839

SCHEMBL12495839

Brc1cccc(-n2c(-c3ccccc3)cc3ccccc32)c1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.48
▸ KMT2A Q03164 2/20 0.47
▸ PLAUR Q03405 1/20 0.47
▸ HAO1 Q9UJM8 1/20 0.47
▸ DCTPP1 Q9H773 1/20 0.46
▸ APP P05067 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ TSHR P16473 2/20 0.41
▸ PLA2G10 O15496 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ ACLY P53396 1/20 0.39
▸ ABCG2 Q9UNQ0 1/20 0.39
▸ PKM P14618 1/20 0.38
▸ MAPT P10636 1/20 0.37
▸ GSK3A P49840 1/20 0.37
▸ GSK3B P49841 1/20 0.37

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
SCHEMBL13425013 0.89 KMT2A (0.55) KMT2AHAO1APPL3MBTL1ALDH1A1
SCHEMBL3861561 0.87 KMT2A (0.50) POLBKMT2APLAURHAO1APP
SCHEMBL1878805 0.85 HAO1 (0.58) KMT2AHAO1APPL3MBTL1ALDH1A1
SCHEMBL3870714 0.84 HAO1 (0.56) KMT2APLAURHAO1APPL3MBTL1
SCHEMBL28281366 0.84 HAO1 (0.49) KMT2APLAURHAO1APPL3MBTL1
SCHEMBL1753892 0.81 KMT2A (0.58) KMT2AHAO1APPL3MBTL1ALDH1A1
SCHEMBL13425022 0.81 HAO1 (0.62) KMT2AHAO1APPL3MBTL1ALDH1A1
SCHEMBL15138181 0.81 HAO1 (0.53) KMT2APLAURHAO1APPL3MBTL1
SCHEMBL14643875 0.81 HAO1 (0.43) POLBKMT2APLAURHAO1APP
SCHEMBL2988465 0.79 PLA2G10 (0.64) POLBKMT2AHAO1APPL3MBTL1

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-2011081423-A2 TRIPHENYLENE COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME 주식회사 두산 (KR) 2011-07-07 — — WO disclosed
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