SCHEMBL9565708

SCHEMBL9565708

COc1cc(C=C2C(=O)N(C)C(=O)N(c3ccccc3)C2=O)cc(OC)c1O

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.68
ALDH1A1 P00352 5/20 0.68
GAA P10253 5/20 0.68
HPGD P15428 3/20 0.68
SIRT1 Q96EB6 4/20 0.57
KMT2A Q03164 10/20 0.55
MEN1 O00255 9/20 0.55
KDM4E B2RXH2 3/20 0.55
KDM1A O60341 1/20 0.54
GFER P55789 1/20 0.52
PSMD14 O00487 2/20 0.51
POLB P06746 3/20 0.50
SIRT2 Q8IXJ6 2/20 0.49
SIRT5 Q9NXA8 2/20 0.49
TDP1 Q9NUW8 1/20 0.48
DHFR P00374 1/20 0.48
PSMB5 P28074 1/20 0.47
PSMB2 P49721 1/20 0.47

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
SCHEMBL9565707 1.00 MAPT (0.68) MAPTALDH1A1GAAHPGDSIRT1
SCHEMBL30020323 0.85 MEN1 (0.53) MAPTALDH1A1GAAHPGDSIRT1
SCHEMBL9565687 0.84 SIRT1 (0.54) MAPTALDH1A1GAAHPGDSIRT1
SCHEMBL9565688 0.84 SIRT1 (0.54) MAPTALDH1A1GAAHPGDSIRT1
SCHEMBL9129353 0.81 SIRT1 (0.57) MAPTALDH1A1GAAHPGDSIRT1
SCHEMBL9129357 0.81 SIRT1 (0.57) MAPTALDH1A1GAAHPGDSIRT1
SCHEMBL30020328 0.73 KMT2A (0.66) MAPTALDH1A1GAAHPGDKMT2A
SCHEMBL12013725 0.73 MEN1 (0.68) MAPTALDH1A1GAAHPGDKMT2A
SCHEMBL21601056 0.73 SIRT1 (1.00) SIRT1KMT2ASIRT2SIRT5
SCHEMBL13848494 0.73 PSMB5 (0.67) MAPTALDH1A1GAAHPGDKMT2A

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-0546661-A1 Pyrimidine derivatives, method for preparation thereof and pharmaceutical composition having said derivatives as active elements JAPAN ENERGY CORPORATION (JP) 1993-06-16 EP disclosed