SCHEMBL9565714

SCHEMBL9565714

CC(C)(C)c1cc(/C=C2\C(=O)NC(=O)N(C3CCCCC3)C2=O)cc(C(C)(C)C)c1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
MAPT P10636 4/20 0.55
HPGD P15428 3/20 0.55
NPSR1 Q6W5P4 2/20 0.55
KDM4E B2RXH2 1/20 0.55
THRB P10828 1/20 0.55
EGFR P00533 1/20 0.49
ERBB2 P04626 1/20 0.49
IGF1R P08069 1/20 0.49
ALDH1A1 P00352 4/20 0.47
PTGS2 P35354 5/20 0.47
PTGS1 P23219 4/20 0.47
EEF2K O00418 1/20 0.47
SRC P12931 1/20 0.47
GAA P10253 3/20 0.46
CTRC Q99895 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
HTT P42858 1/20 0.43
KDM4C Q9H3R0 1/20 0.43

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
SCHEMBL9565715 1.00 MEN1 (0.55) MEN1KMT2AMAPTHPGDNPSR1
SCHEMBL9565718 0.86 EEF2K (0.51) MEN1KMT2AMAPTEGFRERBB2
SCHEMBL9565774 0.83 MAPT (0.43) MEN1KMT2AMAPTHPGDNPSR1
SCHEMBL9565770 0.83 MAPT (0.43) MEN1KMT2AMAPTHPGDNPSR1
SCHEMBL9565700 0.74 MAPT (0.68) MEN1KMT2AMAPTHPGDKDM4E
SCHEMBL9565701 0.74 MAPT (0.68) MEN1KMT2AMAPTHPGDKDM4E
SCHEMBL13045105 0.73 GAA (0.75) MEN1KMT2AEGFRERBB2IGF1R
SCHEMBL13479521 0.73 NOX4 (0.60) MEN1KMT2AMAPTHPGDNPSR1
SCHEMBL9565720 0.71 ALDH1A1 (0.56) MEN1KMT2AMAPTHPGDNPSR1
SCHEMBL14680210 0.71 MAPT (1.00) MEN1KMT2AMAPTHPGDNPSR1

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