SCHEMBL14338570

SCHEMBL14338570

COC(=O)c1cccc(C2=NN(c3cccc(C(=O)OC)c3)C(=O)C2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.50
MAPT P10636 3/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
TP53 P04637 1/20 0.48
XPA P23025 1/20 0.46
TSHR P16473 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
KDM4E B2RXH2 1/20 0.45
CTSG P08311 1/20 0.45
CMA1 P23946 1/20 0.45
ACSS2 Q9NR19 1/20 0.45
HPGD P15428 3/20 0.45
ALDH1A1 P00352 3/20 0.45
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C19 P33261 1/20 0.44
PMM2 O15305 1/20 0.44
MPI P34949 1/20 0.44

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
SCHEMBL5469961 0.94 GAA (0.53) GAAMAPTL3MBTL1MEN1KMT2A
SCHEMBL2228950 0.85 MAPT (0.60) GAAMAPTL3MBTL1MEN1KMT2A
SCHEMBL5455100 0.81 GAA (0.50) GAAMAPTL3MBTL1MEN1KMT2A
SCHEMBL5470613 0.81 GAA (0.48) GAAMAPTL3MBTL1MEN1KMT2A
SCHEMBL5476546 0.79 KMT2A (0.69) GAAMAPTL3MBTL1MEN1KMT2A
SCHEMBL9382350 0.76 MAPT (0.66) GAAMAPTL3MBTL1MEN1KMT2A
SCHEMBL14559413 0.75 KMT2A (0.68) GAAMAPTL3MBTL1MEN1KMT2A
SCHEMBL67941 0.72 CA12 (0.68) TSHRRAB9AGABRG2GABRB3GABRA5
SCHEMBL19644103 0.72 GAA (0.58) GAAMAPTL3MBTL1MEN1KMT2A
SCHEMBL29389131 0.72 GAA (0.58) GAAMAPTL3MBTL1MEN1KMT2A

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
US-20070287822-A1 LIGHT ABSORBING COMPOSITIONS EASTMAN CHEMICAL COMPANY (US) 2007-12-13 US disclosed