SCHEMBL15958685

SCHEMBL15958685

CC(C)(C)c1n[nH]c(/N=N/c2c(C(C)(C)C)nn(-c3ccccc3)c2NS(C)(=O)=O)c1C#N

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
HSP90AA1 P07900 1/20 0.32
KMT2A Q03164 1/20 0.32
PTGS2 P35354 1/20 0.32
FPR1 P21462 1/20 0.31
MAPT P10636 2/20 0.31
ALDH1A1 P00352 2/20 0.31
ATM Q13315 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 3/20 0.31
NPSR1 Q6W5P4 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL12514579 0.85 GAA (0.33) MEN1HSP90AA1KMT2AMAPTATM
SCHEMBL10106254 0.83 L3MBTL1 (0.35)
SCHEMBL12354943 0.83 PTGS2 (0.32) MEN1HSP90AA1KMT2APTGS2FPR1
SCHEMBL10106113 0.81 GAA (0.43) MEN1HSP90AA1KMT2AMAPTALDH1A1
SCHEMBL12363889 0.81 ATM (0.34) MEN1HSP90AA1KMT2AMAPTALDH1A1
SCHEMBL10105984 0.76 MAPT (0.39) MEN1KMT2AMAPTALDH1A1ATM
SCHEMBL12363234 0.76 KDM4E (0.36) MEN1HSP90AA1KMT2AMAPTALDH1A1
SCHEMBL12363685 0.76 MAPT (0.32) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL12514539 0.76 KDM4E (0.44) MEN1HSP90AA1KMT2AMAPTALDH1A1
SCHEMBL12362880 0.74 GRM5 (0.36) MEN1KMT2AMAPTALDH1A1KDM4E

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-8808824-B2 Optical information recording medium, method of recording information and azo metal complex dye FUJIFILM CORPORATION (JP) 2014-08-19 US disclosed