SCHEMBL30931840

SCHEMBL30931840

CC(C)(C)OC(=O)N1CCN(c2ccc(Oc3cc(CO)nc(-c4cc(Cl)cc(Cl)c4)n3)cn2)CC1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 1/20 0.47
▸ ADK P55263 1/20 0.45
▸ PGK1 P00558 1/20 0.44
▸ FURIN P09958 6/20 0.43
▸ RET P07949 8/20 0.43
▸ CKS1B P61024 2/20 0.42
▸ SKP1 P63208 2/20 0.42
▸ SKP2 Q13309 2/20 0.42
▸ WNT3A P56704 1/20 0.41

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
SCHEMBL21551728 1.00 GPR119 (0.47) GPR119ADKPGK1FURINRET
SCHEMBL29890900 0.89 GPR119 (0.51) GPR119ADKPGK1FURINRET
SCHEMBL28546879 0.89 GPR119 (0.51) GPR119ADKPGK1FURINRET
SCHEMBL21551173 0.88 FURIN (0.44) FURIN
SCHEMBL21551595 0.87 GPR119 (0.47) GPR119ADKPGK1FURINRET
SCHEMBL30931838 0.87 GPR119 (0.47) GPR119ADKPGK1FURINRET
SCHEMBL21550824 0.86 GPR119 (0.45) GPR119ADKPGK1FURINRET
SCHEMBL30931806 0.85 FURIN (0.55) GPR119ADKPGK1FURINRET
SCHEMBL21551238 0.85 FURIN (0.55) GPR119ADKPGK1FURINRET
SCHEMBL29890947 0.85 FURIN (0.55) GPR119ADKPGK1FURINRET

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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