SCHEMBL3264084

SCHEMBL3264084

O=Cc1ccc(-c2ccc(Nc3ccccc3O)nc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.38
POLB P06746 1/20 0.38
TEK Q02763 1/20 0.37
MAPK8 P45983 1/20 0.37
MAPK10 P53779 2/20 0.36
PIK3CA P42336 1/20 0.36
PRKDC P78527 1/20 0.36
KDR P35968 1/20 0.36
PLK1 P53350 1/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
MAPT P10636 2/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
RECQL P46063 1/20 0.35
PKM P14618 1/20 0.35
HPGD P15428 1/20 0.35
DEGS1 O15121 1/20 0.35

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
SCHEMBL3261356 0.87 CDK8 (0.44) GAAPOLBMAPK10PIK3CAPRKDC
SCHEMBL3262264 0.82 TRIM24 (0.41) GAAPOLBMAPK8MAPK10PIK3CA
SCHEMBL3265734 0.73 MEN1 (0.50) MAPK10KDRMEN1KMT2AMAPT
SCHEMBL28485324 0.72 DEGS1 (0.40) GAAPOLBPIK3CAKDRKMT2A
SCHEMBL21386707 0.71 MAPK10 (0.46) POLBMAPK10PIK3CAPRKDCMAPT
SCHEMBL3241851 0.70 TEK (0.40) POLBTEKMAPK10KDRMAPT
SCHEMBL31737439 0.70 ALDH5A1 (0.46) MEN1KMT2A
SCHEMBL3241814 0.69 KDR (0.46) POLBKDRMEN1KMT2AMAPT
SCHEMBL31737159 0.69 CDK6 (0.36) DEGS1
SCHEMBL31737264 0.68 GSK3B (0.45) TEKKDR

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-2010057833-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-05-27 WO claimed