SCHEMBL7703296

SCHEMBL7703296

O=C(Nc1ccc(-c2oc(-c3ccccc3)nc2C(=O)N2CCN(c3ccccc3)CC2)cc1)c1ccncc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 4/20 0.51
MAPT P10636 7/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
MAPK1 P28482 3/20 0.49
ALDH1A1 P00352 3/20 0.49
TSHR P16473 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.49
NAMPT P43490 2/20 0.48
USP2 O75604 3/20 0.48
KDM4E B2RXH2 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
ALOX15 P16050 1/20 0.48
NTSR1 P30989 1/20 0.48
HSD17B10 Q99714 1/20 0.48
FLT3 P36888 1/20 0.47
TP53 P04637 1/20 0.47
HTT P42858 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47

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 0.94 MAPT (0.54) DGAT1MAPTL3MBTL1MAPK1ALDH1A1
SCHEMBL7699160 0.90 SMN1; SMN2 (0.57) DGAT1MAPTMAPK1ALDH1A1SMN1; SMN2
SCHEMBL7699504 0.90 MAPT (0.55) DGAT1MAPTL3MBTL1MAPK1ALDH1A1
SCHEMBL7697612 0.90 L3MBTL1 (0.60) DGAT1MAPTL3MBTL1MAPK1SMN1; SMN2
SCHEMBL7697604 0.88 KDM4E (0.55) DGAT1MAPTL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL7699501 0.88 MAPT (0.55) DGAT1MAPTL3MBTL1MAPK1LMNA
SCHEMBL7695366 0.86 USP2 (0.56) DGAT1MAPTL3MBTL1MAPK1ALDH1A1
SCHEMBL7695332 0.86 NPC1 (0.56) DGAT1MAPTL3MBTL1MAPK1ALDH1A1
SCHEMBL7697962 0.86 L3MBTL1 (0.56) DGAT1MAPTL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL7698228 0.85 MAPT (0.56) DGAT1MAPTL3MBTL1ALDH1A1SMN1; SMN2

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