SCHEMBL8566265

SCHEMBL8566265

Cc1ncc(Cn2c([S+]([O-])C3CCN(C(=O)OC(C)(C)C)CC3)nc3ccccc32)o1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.41
SMN1; SMN2 Q16637 2/20 0.38
GAA P10253 1/20 0.38
THRB P10828 1/20 0.38
CCR5 P51681 1/20 0.38
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
OGFRL1 Q5TC84 1/20 0.38
NOD2 Q9HC29 1/20 0.38
NOD1 Q9Y239 1/20 0.38
MMP3 P08254 1/20 0.37
MMP7 P09237 1/20 0.37
MMP10 P09238 1/20 0.37
MMP8 P22894 1/20 0.37
MMP12 P39900 1/20 0.37
KDM4E B2RXH2 1/20 0.37
PKM P14618 1/20 0.37
MAPT P10636 3/20 0.37
TP53 P04637 1/20 0.37
HPGDS O60760 1/20 0.37

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
SCHEMBL8565135 0.83 GPR119 (0.42) GPR119SMN1; SMN2GAATHRBCCR5
SCHEMBL9697550 0.83 HRH1 (0.43) GPR119SMN1; SMN2GAATHRBCCR5
SCHEMBL8567057 0.73 ALDH1A1 (0.46) SMN1; SMN2GAAOPRM1OPRD1OGFRL1
SCHEMBL8566268 0.73 ALDH1A1 (0.42) SMN1; SMN2KDM4EMAPT
SCHEMBL8561156 0.73 ALDH1A1 (0.42) SMN1; SMN2KDM4EMAPT
SCHEMBL8561759 0.72 ALDH1A1 (0.51) SMN1; SMN2GAAKDM4EMAPT
SCHEMBL8565649 0.72 ALDH1A1 (0.44) SMN1; SMN2GAATHRBKDM4EMAPT
SCHEMBL9543786 0.70 ALDH1A1 (0.52) SMN1; SMN2KDM4E
SCHEMBL23022544 0.69 BRD4 (0.52) GPR119CCR5OPRM1OPRD1OGFRL1
SCHEMBL7471630 0.69 HRH1 (0.44) GPR119SMN1; SMN2GAATHRBCCR5

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 4 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
WO-1992001687-A1 NOVEL OXAZOLYL DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1992-02-06 WO disclosed