SCHEMBL13356451

SCHEMBL13356451

O=Cc1ccccc1-c1ccc(Nc2cccc(O)c2)nc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.49
MAPT P10636 2/20 0.45
TP53 P04637 1/20 0.45
SYK P43405 3/20 0.43
CYP3A4 P08684 1/20 0.42
TSHR P16473 1/20 0.42
BRAF P15056 7/20 0.41
RAF1 P04049 3/20 0.41
ABCG2 Q9UNQ0 1/20 0.41
KDR P35968 1/20 0.40
PLK1 P53350 1/20 0.40
GSK3B P49841 2/20 0.40
STK10 O94804 1/20 0.39
SLK Q9H2G2 1/20 0.39
HCAR3 P49019 1/20 0.39
MEN1 O00255 1/20 0.39
APAF1 O14727 1/20 0.39
NSD2 O96028 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 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
SCHEMBL3240510 0.83 KDR (0.45) MAPTKDRHCAR3MEN1ALDH1A1
SCHEMBL3242738 0.83 KDM4E (0.54) MAPTTP53KDRMEN1ALDH1A1
SCHEMBL3247925 0.81 KDR (0.42) HDAC6MAPTKDRMEN1RAB9A
SCHEMBL3246021 0.81 TDP2 (0.44) TSHRKDRGSK3BHCAR3NSD2
SCHEMBL3242077 0.81 CTSC (0.47) SYKCYP3A4
SCHEMBL3262625 0.79 RHOA (0.51) MAPTTP53BRAFABCG2MEN1
SCHEMBL3262264 0.78 TRIM24 (0.41) MAPTKDRPLK1MEN1APAF1
SCHEMBL3238724 0.77 MEN1 (0.43) MAPTTP53BRAFMEN1ALDH1A1
SCHEMBL13356400 0.76 MEN1 (0.40) MAPTTP53SYKMEN1RAB9A
SCHEMBL3247960 0.75 KMT2A (0.51) MAPTKDRMEN1ALDH1A1RAB9A

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 disclosed