SCHEMBL30644685

SCHEMBL30644685

CC(c1ccc2cccnc2c1)N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OGA O60502 7/20 0.60
POLB P06746 1/20 0.48
TBK1 Q9UHD2 9/20 0.47
CYP3A4 P08684 1/20 0.44
CYP3A5 P20815 1/20 0.44

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
SCHEMBL24499881 1.00 OGA (0.60) OGAPOLBTBK1CYP3A4CYP3A5
SCHEMBL30644627 0.87 OGA (0.55) OGATBK1
SCHEMBL17541630 0.87 OGA (0.55) OGATBK1
SCHEMBL20482207 0.84 OGA (0.68) OGA
SCHEMBL31023653 0.82 OPRD1 (0.51) POLBCYP3A4CYP3A5
SCHEMBL2420167 0.80 POLB (0.52) POLB
SCHEMBL20481999 0.79 OGA (0.53) OGATBK1
SCHEMBL30644622 0.79 OGA (0.53) OGATBK1
SCHEMBL20482285 0.78 OGA (0.52) OGATBK1
SCHEMBL30644615 0.78 OGA (0.52) OGATBK1

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-110770226-B Sulfoximine glycosidase inhibitors 阿森纽荣股份公司 2023-11-10 CN disclosed