SCHEMBL8574686

SCHEMBL8574686

COC(=O)c1sc(N)nc1OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.48
PKM P14618 2/20 0.48
ALDH1A1 P00352 9/20 0.44
CYP1A2 P05177 1/20 0.44
HSD17B10 Q99714 3/20 0.43
HPGD P15428 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
GAA P10253 2/20 0.43
MAPK1 P28482 1/20 0.43
MAPT P10636 3/20 0.42
KMT2A Q03164 3/20 0.42
TSHR P16473 1/20 0.42
MEN1 O00255 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CDC7 O00311 1/20 0.40
CCNE1 P24864 1/20 0.40
CDK2 P24941 1/20 0.40
DBF4 Q9UBU7 1/20 0.40
GLA P06280 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL28757968 0.80 ALDH1A1 (0.44) KDM4EPKMALDH1A1CYP1A2HSD17B10
SCHEMBL276275 0.79 ALDH1A1 (0.62) KDM4EPKMALDH1A1CYP1A2HPGD
SCHEMBL8146643 0.78 KDM4E (0.48) KDM4EPKMALDH1A1CYP1A2HSD17B10
SCHEMBL1552673 0.76 ALDH1A1 (0.54) KDM4EPKMALDH1A1CYP1A2HSD17B10
SCHEMBL2444986 0.76 ALDH1A1 (0.50) KDM4EPKMALDH1A1CYP1A2HSD17B10
SCHEMBL2624097 0.75 KDM4E (0.42) KDM4EPKMALDH1A1CYP1A2HSD17B10
SCHEMBL2441749 0.75 KDM4E (0.42) KDM4EPKMALDH1A1CYP1A2HSD17B10
SCHEMBL1540028 0.75 ALDH1A1 (0.49) KDM4EPKMALDH1A1CYP1A2HSD17B10
SCHEMBL2444646 0.74 L3MBTL1 (0.46) KDM4EPKMALDH1A1CYP1A2HSD17B10
SCHEMBL19185698 0.74 KDM4E (0.41) KDM4EPKMALDH1A1CYP1A2HSD17B10

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5811554-A REACTING AN IMINOETHER WITH A HALOGENATING AGENT AND THIOUREA; USED IN MAKING NOVEL AZO DYES AGFA-GEVAERT, N.V. (BE) 1998-09-22 US claimed
EP-0687674-A1 Preparation of 2-amino-4-alkoxythiazoles being negatively substituted in the 5 position AGFA-GEVAERT N.V. (BE) 1995-12-20 EP claimed