SCHEMBL20090726

SCHEMBL20090726

CN1CCS(=O)(=NCC2CC2)CC1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 1/20 0.34

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
SCHEMBL20090523 0.78
SCHEMBL23624917 0.69
SCHEMBL25612930 0.68 THRA (0.33)
SCHEMBL25481721 0.67 KDM1A (0.32)
SCHEMBL23625108 0.67 NCF1 (0.32) NCF1
SCHEMBL19135303 0.66
SCHEMBL13270572 0.66 NCF1 (0.50) NCF1
SCHEMBL24005394 0.65
SCHEMBL4868680 0.63 NCF1 (0.52) NCF1
SCHEMBL23624918 0.61

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
WO-2018072697-A1 OXADIAZOLE RING-CONTAINING COMPOUND, PREPARATION METHOD THEREFOR, AND INTERMEDIATE, COMPOSITE, AND APPLICATION THEREOF 上海医药集团股份有限公司 2018-04-26 WO disclosed