SCHEMBL2534824

SCHEMBL2534824

CC(=O)N(C)c1ccc2c(c1)C(C)(C)C(=O)N2C

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.48
▸ PKM P14618 1/20 0.48
▸ POLB P06746 2/20 0.46
▸ MEN1 O00255 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ MAPT P10636 2/20 0.43
▸ PDE4A P27815 2/20 0.41
▸ PDE4B Q07343 2/20 0.41
▸ PDE4C Q08493 2/20 0.41
▸ PDE4D Q08499 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ PDK2 Q15119 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ TP53 P04637 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
SCHEMBL10696332 0.89 POLB (0.41) GAAPKMPOLBMEN1KMT2A
SCHEMBL17231387 0.76 MEN1 (0.47) POLBMEN1KMT2AMAPTPDE4A
SCHEMBL10381827 0.73 PKM (0.51) GAAPKMPOLBMEN1KMT2A
SCHEMBL3935379 0.73 IP6K1 (0.52) POLBMEN1KMT2AMAPTPDE4A
SCHEMBL5539734 0.72 MEN1 (0.56) PKMPOLBMEN1KMT2AMAPT
SCHEMBL2490105 0.71 MPI (0.43) GAAPKMPOLBMEN1KMT2A
SCHEMBL24201847 0.70 MEN1 (0.50) GAAPKMPOLBMEN1KMT2A
SCHEMBL9028558 0.70 MEN1 (0.50) GAAPKMPOLBMEN1KMT2A
SCHEMBL13993447 0.70 MEN1 (0.50) GAAPKMPOLBMEN1KMT2A
SCHEMBL5539731 0.70 MEN1 (0.50) GAAPKMPOLBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1756112-B1 PYRROLOBENZIMIDAZOLONES AND THEIR USE AS ANTIPROLIFERATIVE AGENTS BOEHRINGER INGELHEIM INT (DE) 2011-10-26 — — EP disclosed
EP-1598353-A1 Pyrrolobenzimidazolones and their use as antiproliferative agents Boehringer Ingelheim International GmbH (DE) 2005-11-23 — — EP disclosed
EP-0268178-A1 Pyrrolo-benzimidazoles, medicaments containing these compounds and process for their preparation Dr. Karl Thomae GmbH (DE) 1988-05-25 — — EP disclosed
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