SCHEMBL7696355

SCHEMBL7696355

CN(C)c1ccc(-c2oc(-c3ccccc3-c3ccccc3)nc2C(=O)NCc2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
POLB P06746 1/20 0.45
CHRNB2 P17787 1/20 0.44
CHRNB4 P30926 1/20 0.44
CHRNA3 P32297 1/20 0.44
CHRNA4 P43681 1/20 0.44
GSK3B P49841 2/20 0.44
EGFR P00533 1/20 0.42
PPARG P37231 1/20 0.42
MAPK1 P28482 2/20 0.41
DCLK1 O15075 1/20 0.41
PRKD3 O94806 1/20 0.41
MAP4K4 O95819 1/20 0.41
CHEK2 O96017 1/20 0.41
RET P07949 1/20 0.41
FER P16591 1/20 0.41
RPS6KB1 P23443 1/20 0.41
FLT4 P35916 1/20 0.41
FLT3 P36888 1/20 0.41
MAPK9 P45984 1/20 0.41

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
SCHEMBL7700999 0.92 MAPT (0.48) MAPTPOLBGSK3BMAPK1DCLK1
SCHEMBL7694290 0.88 TACR1 (0.51) CNR2
SCHEMBL7701529 0.87 POLB (0.52) MAPTPOLBMAPK1KDM4EALDH1A1
SCHEMBL7699884 0.86 HPGD (0.42) MAPTPOLBMAPK1KDM4EALDH1A1
SCHEMBL7695429 0.86 ADORA2A (0.39) GSK3BMAPK1KDM4EALDH1A1CYP1A2
SCHEMBL7699427 0.86 HTT (0.49) MAPTPOLBMAPK1KDM4EALDH1A1
SCHEMBL7694391 0.85 CNR1 (0.46) PPARGCNR2HDAC4KDM4ECYP1A2
SCHEMBL7695817 0.84 MAOB (0.42) MAPTPOLBKDM4EALDH1A1HSD17B10
SCHEMBL7699604 0.84 MAPT (0.47) MAPTCHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL7695160 0.84 MAPT (0.41) MAPTMAPK1KDM4EALDH1A1CYP1A2

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