SCHEMBL4079920

SCHEMBL4079920

COc1cc2c(cc1OC)C(=O)N(Br)C2

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ CYP3A4 P08684 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ ACHE P22303 2/20 0.45
▸ MAPT P10636 1/20 0.42
▸ MAOA P21397 2/20 0.40
▸ MAOB P27338 2/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ GAA P10253 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ PDE4D Q08499 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA7 P43166 1/20 0.39
▸ CA9 Q16790 1/20 0.39

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
SCHEMBL11923833 0.80 MEN1 (0.70) MEN1KMT2ACYP3A4ALDH1A1L3MBTL1
SCHEMBL10200133 0.78 MEN1 (0.50) MEN1KMT2ACYP3A4ALDH1A1L3MBTL1
SCHEMBL29322848 0.76 KMT2A (0.51) MEN1KMT2ACYP3A4ALDH1A1L3MBTL1
SCHEMBL12043669 0.76 MEN1 (0.51) MEN1KMT2ACYP3A4ALDH1A1L3MBTL1
SCHEMBL30179164 0.72 MEN1 (0.48) MEN1KMT2ACYP3A4ALDH1A1PDE4D
SCHEMBL29324429 0.72 MEN1 (0.48) MEN1KMT2ACYP3A4ALDH1A1PDE4D
SCHEMBL11164747 0.71 MAOA (0.51) MEN1KMT2ACYP3A4ALDH1A1ACHE
SCHEMBL1608784 0.70 HTR2C (0.50) MEN1KMT2AMAPT
SCHEMBL11923834 0.70 MEN1 (1.00) MEN1KMT2ACYP3A4ALDH1A1MAPT
SCHEMBL30883376 0.70 MEN1 (1.00) MEN1KMT2ACYP3A4ALDH1A1MAPT

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-2009051417-A2 PHENANTHRENE LACTAM DERIVATIVES HAVING ANTICANCER ACTIVITY AND METHOD FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2009-04-23 — — WO disclosed
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