SCHEMBL30931838

SCHEMBL30931838

CC(C)(C)OC(=O)N1CCN(c2ccc(Oc3nc(CO)cc(-c4cc(Cl)cc(Cl)c4)n3)cn2)CC1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 1/20 0.47
▸ PGK1 P00558 1/20 0.45
▸ ADK P55263 1/20 0.45
▸ CKS1B P61024 2/20 0.44
▸ SKP1 P63208 2/20 0.44
▸ SKP2 Q13309 2/20 0.44
▸ FURIN P09958 4/20 0.43
▸ RET P07949 9/20 0.43
▸ WNT3A P56704 1/20 0.41
▸ SUV39H2 Q9H5I1 1/20 0.40

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
SCHEMBL21551595 1.00 GPR119 (0.47) GPR119PGK1ADKCKS1BSKP1
SCHEMBL21551559 0.89 GPR119 (0.51) GPR119PGK1ADKCKS1BSKP1
SCHEMBL21551728 0.87 GPR119 (0.47) GPR119PGK1ADKCKS1BSKP1
SCHEMBL30931840 0.87 GPR119 (0.47) GPR119PGK1ADKCKS1BSKP1
SCHEMBL21553728 0.86 PGK1 (0.47) GPR119PGK1ADKCKS1BSKP1
SCHEMBL30931806 0.85 FURIN (0.55) GPR119PGK1ADKCKS1BSKP1
SCHEMBL29890947 0.85 FURIN (0.55) GPR119PGK1ADKCKS1BSKP1
SCHEMBL21551238 0.85 FURIN (0.55) GPR119PGK1ADKCKS1BSKP1
SCHEMBL21550657 0.84 FURIN (0.61) GPR119PGK1ADKCKS1BSKP1
SCHEMBL21551128 0.83 GPR119 (0.46) GPR119PGK1ADKCKS1BSKP1

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
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
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