SCHEMBL10047411

SCHEMBL10047411

Bc1cc2c(cc1Br)C(=O)c1ccccc1C2=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ CDC25B P30305 1/20 0.50
▸ PTPRC P08575 3/20 0.48
▸ BCL2 P10415 1/20 0.48
▸ MCL1 Q07820 1/20 0.48
▸ ALDH1A1 P00352 6/20 0.45
▸ NPC1 O15118 5/20 0.45
▸ RAB9A P51151 5/20 0.45
▸ MAPK1 P28482 4/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ TP53 P04637 2/20 0.45
▸ CYP3A4 P08684 2/20 0.45
▸ ELANE P08246 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ AURKA O14965 1/20 0.45
▸ AURKB Q96GD4 1/20 0.45
▸ IDO1 P14902 1/20 0.43
▸ DNMT1 P26358 1/20 0.43

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
SCHEMBL571761 0.84 MEN1 (0.63) MEN1KMT2ACDC25BPTPRCBCL2
SCHEMBL14621715 0.84 MEN1 (0.63) MEN1KMT2ACDC25BPTPRCBCL2
SCHEMBL24730390 0.80 PTPRC (0.59) MEN1KMT2ACDC25BPTPRCBCL2
SCHEMBL8770439 0.75 ALDH1A1 (0.55) MEN1KMT2ACDC25BPTPRCBCL2
SCHEMBL11359105 0.75 BCL2 (0.72) MEN1KMT2ACDC25BPTPRCBCL2
SCHEMBL9175638 0.75 ELANE (0.55) MEN1KMT2ACDC25BPTPRCBCL2
SCHEMBL30804365 0.75 ALDH1A1 (0.55) MEN1KMT2ACDC25BPTPRCBCL2
SCHEMBL9736945 0.74 MEN1 (0.55) MEN1KMT2ACDC25BPTPRCBCL2
Anthraquinone SCHEMBL28260408 0.74 MEN1 (0.92) MEN1KMT2ACDC25BPTPRCBCL2
SCHEMBL1143212 0.72 ALDH1A1 (0.52) MEN1KMT2ACDC25BPTPRCBCL2

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
WO-2012157440-A1 DISPIRODIBENZONAPHTHACENE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE HAVING THE SAME CANON KABUSHIKI KAISHA (JP) 2012-11-22 — — WO disclosed
WO-2012017977-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING SAME CANON KABUSHIKI KAISHA (JP) 2012-02-09 — — WO disclosed
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