SCHEMBL8565135

SCHEMBL8565135

Cc1ncc(Cn2c(SC3CCN(C(=O)OC(C)(C)C)CC3)nc3ccccc32)o1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.42
MMP7 P09237 2/20 0.42
MMP8 P22894 2/20 0.42
MMP12 P39900 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
GAA P10253 1/20 0.42
THRB P10828 1/20 0.42
MAPK1 P28482 2/20 0.41
MAPT P10636 2/20 0.40
CCR5 P51681 1/20 0.39
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39
OGFRL1 Q5TC84 1/20 0.39
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
NOD2 Q9HC29 1/20 0.39
NOD1 Q9Y239 1/20 0.39
MMP3 P08254 1/20 0.39
MMP10 P09238 1/20 0.39
HPGDS O60760 1/20 0.38

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
SCHEMBL9697550 0.85 HRH1 (0.43) GPR119MMP7MMP8MMP12SMN1; SMN2
SCHEMBL8566265 0.83 GPR119 (0.41) GPR119MMP7MMP8MMP12SMN1; SMN2
SCHEMBL8565877 0.78 HSD11B1 (0.46) SMN1; SMN2GAAMAPK1MAPTPKM
SCHEMBL2774814 0.78 LMNA (0.47) GPR119SMN1; SMN2GAATHRBMAPK1
SCHEMBL8567057 0.75 ALDH1A1 (0.46) MMP7MMP8MMP12SMN1; SMN2GAA
SCHEMBL8561156 0.75 ALDH1A1 (0.42) SMN1; SMN2MAPK1MAPTKDM4E
SCHEMBL8566268 0.75 ALDH1A1 (0.42) SMN1; SMN2MAPK1MAPTKDM4E
SCHEMBL8561759 0.74 ALDH1A1 (0.51) SMN1; SMN2GAAMAPK1MAPTKDM4E
SCHEMBL8565649 0.74 ALDH1A1 (0.44) SMN1; SMN2GAATHRBMAPK1MAPT
Sulfamic Acid Cyclohexyl Ester SCHEMBL9302699 0.73 MAPK1 (0.41) SMN1; SMN2MAPK1MAPTKDM4EMC4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0539421-B1 NOVEL OXAZOLYL DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 1998-09-23 EP disclosed
US-5278165-A Oxazolyl imidazol[4,5-b]pyridin and pyrimidine compounds JANSSEN PHARMACEUTICA N.V. (BE) 1994-01-11 US disclosed
US-5217980-A Antiallergens JANSSEN PHARMACEUTICA N.V. (BE) 1993-06-08 US disclosed
EP-0539421-A1 NOVEL OXAZOLYL DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1993-05-05 EP disclosed
WO-1992001687-A1 NOVEL OXAZOLYL DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1992-02-06 WO disclosed