SCHEMBL21551664

SCHEMBL21551664

COC(=O)c1cc(Cl)nc(Oc2cnc(N3CCN(C(=O)OC(C)(C)C)C(C)C3)nc2)c1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.49
HDAC1 Q13547 1/20 0.42
MAP4K4 O95819 1/20 0.42
SUV39H2 Q9H5I1 2/20 0.41
CHRM4 P08173 6/20 0.40
CHRM2 P08172 1/20 0.37
CHRM1 P11229 1/20 0.37
SLC6A7 Q99884 2/20 0.36
UCHL1 P09936 1/20 0.36
USP30 Q70CQ3 1/20 0.36

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
SCHEMBL28551924 1.00 GPR119 (0.49) GPR119HDAC1MAP4K4SUV39H2CHRM4
SCHEMBL21551584 0.89 GPR119 (0.46) GPR119HDAC1MAP4K4SUV39H2SLC6A7
SCHEMBL21551582 0.89 GPR119 (0.46) GPR119HDAC1MAP4K4SUV39H2SLC6A7
SCHEMBL21551176 0.88 CHRM4 (0.42) GPR119CHRM4CHRM2CHRM1SLC6A7
SCHEMBL28551699 0.88 CHRM4 (0.42) GPR119CHRM4CHRM2CHRM1SLC6A7
SCHEMBL29891316 0.87 GPR119 (0.48) GPR119
SCHEMBL21553761 0.87 GPR119 (0.48) GPR119
SCHEMBL29890912 0.83 GPR119 (0.46) GPR119SUV39H2
SCHEMBL21551729 0.83 GPR119 (0.46) GPR119SUV39H2
SCHEMBL31713165 0.83 GPR119 (0.58) GPR119HDAC1MAP4K4SUV39H2CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112384509-B Furin inhibitors 葛兰素史密斯克莱知识产权发展有限公司 2024-04-30 CN disclosed
EP-3790871-B1 FURIN INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2024-01-24 EP disclosed
EP-3790871-A1 FURIN INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2021-03-17 EP disclosed
CN-112384509-A Furin inhibitors 葛兰素史密斯克莱知识产权发展有限公司 2021-02-19 CN disclosed
WO-2019215341-A1 FURIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-11-14 WO disclosed
WO-2019215341-A1 FURIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-11-14 WO disclosed