SCHEMBL15958699

SCHEMBL15958699

CCOC(=O)c1nn(-c2ccccc2)c(O)c1/N=N/c1[nH]nc(C(C)(C)C)c1C#N

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.51
ALDH1A1 P00352 7/20 0.47
HPGD P15428 4/20 0.43
HSD17B10 Q99714 2/20 0.43
MAPT P10636 3/20 0.41
MAPK1 P28482 1/20 0.41
PIK3CD O00329 1/20 0.40
PIK3CA P42336 1/20 0.40
PIK3CB P42338 1/20 0.40
PIK3CG P48736 1/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
TP53 P04637 1/20 0.39
ALOX12 P18054 1/20 0.39
GAA P10253 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
ADORA1 P30542 1/20 0.38

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
SCHEMBL12514539 0.89 KDM4E (0.44) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL12514538 0.85 MAPT (0.42) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL12363228 0.84 KDM4E (0.37) KDM4EALDH1A1
SCHEMBL10106111 0.84 KDM4E (0.35) KDM4EALDH1A1MAPTMAPK1GAA
SCHEMBL10105984 0.84 MAPT (0.39) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL12363889 0.84 ATM (0.34) KDM4EALDH1A1HPGDMAPTMAPK1
SCHEMBL12363234 0.82 KDM4E (0.36) KDM4EALDH1A1MAPTMAPK1GAA
SCHEMBL12363684 0.81 KDM4E (0.32) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL12362880 0.80 GRM5 (0.36) KDM4EALDH1A1HSD17B10MAPTNPSR1
SCHEMBL12363685 0.79 MAPT (0.32) KDM4EALDH1A1MAPTGAANPSR1

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