SCHEMBL7697604

SCHEMBL7697604

COc1ccc(C(=O)Nc2ccc(-c3oc(-c4ccccc4)nc3C(=O)N3CCN(c4ccccc4)CC3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.55
KMT2A Q03164 3/20 0.54
HSD17B10 Q99714 1/20 0.54
DGAT1 O75907 1/20 0.54
MAPT P10636 8/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
TP53 P04637 3/20 0.52
RAB9A P51151 3/20 0.52
NPC1 O15118 2/20 0.52
ALDH1A1 P00352 1/20 0.51
NR4A1 P22736 1/20 0.51
MCL1 Q07820 1/20 0.51
SLC1A2 P43004 1/20 0.51
POLB P06746 2/20 0.51
NAMPT P43490 1/20 0.49
SMN1; SMN2 Q16637 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
SCHEMBL7696391 0.91 MAPT (0.54) KDM4EKMT2AHSD17B10DGAT1MAPT
SCHEMBL7700066 0.91 NPC1 (0.58) KDM4EKMT2AHSD17B10DGAT1MAPT
SCHEMBL7699504 0.91 MAPT (0.55) KDM4EKMT2ADGAT1MAPTL3MBTL1
SCHEMBL7697612 0.89 L3MBTL1 (0.60) KMT2ADGAT1MAPTL3MBTL1TP53
SCHEMBL7699501 0.88 MAPT (0.55) KMT2AHSD17B10DGAT1MAPTL3MBTL1
SCHEMBL7703296 0.88 DGAT1 (0.51) KDM4EHSD17B10DGAT1MAPTL3MBTL1
SCHEMBL7695770 0.86 MAPT (0.58) KDM4EHSD17B10DGAT1MAPTL3MBTL1
SCHEMBL7695332 0.85 NPC1 (0.56) KDM4EKMT2AHSD17B10DGAT1MAPT
SCHEMBL7697962 0.85 L3MBTL1 (0.56) KDM4EKMT2ADGAT1MAPTL3MBTL1
SCHEMBL7699160 0.84 SMN1; SMN2 (0.57) KDM4EKMT2AHSD17B10DGAT1MAPT

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