Sugi Predict

Sugi Predict / Compounds / SCHEMBL28053571

SCHEMBL28053571

SCHEMBL28053571

COC1CC(C)N(CCc2ccccc2)C1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 3/20 0.54
▸ OPRM1 P35372 1/20 0.45
▸ OPRD1 P41143 1/20 0.45
▸ OPRK1 P41145 1/20 0.45
▸ GAA P10253 1/20 0.44
▸ HRH3 Q9Y5N1 5/20 0.44
▸ MAPT P10636 1/20 0.43
▸ ACHE P22303 1/20 0.43
▸ HTR1A P08908 3/20 0.40
▸ DRD2 P14416 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
SCHEMBL14660573 0.85 HRH3 (0.51) SIGMAR1HRH3ACHEHTR1ADRD2
SCHEMBL27616211 0.84 MAPT (0.60) SIGMAR1MAPT
SCHEMBL19290959 0.84 MAPT (0.60) SIGMAR1MAPT
SCHEMBL18857789 0.76 SIGMAR1 (0.54) SIGMAR1OPRM1OPRD1OPRK1GAA
SCHEMBL28053573 0.76 SIGMAR1 (0.54) SIGMAR1OPRM1OPRD1OPRK1GAA
SCHEMBL13865770 0.73 GAA (0.34) GAADRD2
SCHEMBL14660575 0.73 GBA1 (0.52) SIGMAR1HRH3MAPTACHE
SCHEMBL4513431 0.73 GBA1 (0.52) SIGMAR1HRH3MAPTACHE
SCHEMBL22668719 0.73 GBA1 (0.52) SIGMAR1HRH3MAPTACHE
SCHEMBL18834993 0.73 MAPT (0.50) SIGMAR1MAPTACHEHTR1A

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-105246888-A Imidazopyridine compounds and uses thereof TECHNOLOGY SG L P 2016-01-13 — — CN disclosed