SCHEMBL12433320

SCHEMBL12433320

Cc1ccc(O)c(NC(=O)C(C)NC(=O)OC(C)(C)C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
THRB P10828 1/20 0.48
MAPT P10636 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
KCNMA1 Q12791 3/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
AAK1 Q2M2I8 1/20 0.42
HTT P42858 2/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
POLB P06746 1/20 0.41
MAPK1 P28482 1/20 0.41
KDM4E B2RXH2 1/20 0.41
GLA P06280 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL7916871 0.85 KDM4E (0.50) GAAMEN1KMT2AMAPTAAK1
SCHEMBL12432823 0.85 HRH2 (0.42) GAAMAPTAAK1KDM4EGLA
SCHEMBL2031546 0.85 KCNMA1 (0.54) GAAMAPTSMN1; SMN2KCNMA1NPC1
SCHEMBL1390928 0.84 KDM4E (0.48) GAAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL1390927 0.84 KDM4E (0.48) GAAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL13497782 0.83 CYP1A2 (0.46) GAAMEN1KMT2ATHRBMAPT
SCHEMBL15020425 0.83 HPGD (0.51) GAAMEN1KMT2AMAPTNPC1
SCHEMBL12432821 0.81 GAA (0.56) GAAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL8071230 0.81 MEN1 (0.43) GAAMEN1KMT2ATHRBMAPT
SCHEMBL12432828 0.78 HRH2 (0.42) GAAMEN1KMT2AMAPTSMN1; SMN2

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
EP-2351743-A1 BICYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2011-08-03 EP disclosed