SCHEMBL7698000

SCHEMBL7698000

COc1ccc(NC(=O)c2nc(-c3ccccc3)oc2-c2ccc(NC(C)=O)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.65
GAA P10253 2/20 0.65
STAT3 P40763 2/20 0.57
MAPT P10636 7/20 0.55
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
DGAT1 O75907 1/20 0.53
TP53 P04637 1/20 0.53
ALDH1A1 P00352 5/20 0.51
LMNA P02545 3/20 0.51
HPGD P15428 3/20 0.51
HSD17B10 Q99714 2/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
CACNA1B Q00975 1/20 0.51
APBA1 Q02410 1/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
KDR P35968 1/20 0.49
USP2 O75604 1/20 0.49

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
SCHEMBL7703233 0.91 KDM4E (0.73) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL7694070 0.91 KDM4E (0.73) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL7695082 0.89 MAPT (0.50) KDM4EGAASTAT3MAPTMEN1
SCHEMBL7696428 0.89 STAT3 (0.55) KDM4EGAASTAT3MAPTMEN1
SCHEMBL7701387 0.88 MAPT (0.69) KDM4EGAASTAT3MAPTMEN1
SCHEMBL7703322 0.88 KDM4E (0.72) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL7698787 0.86 KDM4E (0.58) KDM4EGAASTAT3MAPTKMT2A
SCHEMBL7704976 0.86 MAPT (0.61) KDM4EGAASTAT3MAPTMEN1
SCHEMBL7699293 0.86 KDM4E (0.53) KDM4EGAASTAT3MAPTMEN1
SCHEMBL7699119 0.86 KDM4E (0.50) KDM4EGAASTAT3MAPTMEN1

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
WO-2002064558-A2 OXAZOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS CYTOKINE INHIBITORS SANKYO COMPANY, LIMITED (JP) 2002-08-22 WO disclosed