SCHEMBL28742007

SCHEMBL28742007

CN1CC=C(OB(O)O)CC1

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
QDPR P09417 3/20 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
SCHEMBL14593836 0.73 QDPR (0.41) QDPR
SCHEMBL2877216 0.71 QDPR (0.38) QDPR
SCHEMBL7948663 0.70 QDPR (0.39) QDPR
SCHEMBL29233999 0.70 PDK4 (0.46)
SCHEMBL9951901 0.69 QDPR (0.44) QDPR
SCHEMBL5513283 0.69 QDPR (0.37) QDPR
SCHEMBL14627117 0.69 QDPR (0.37) QDPR
SCHEMBL14593823 0.69 QDPR (0.37) QDPR
SCHEMBL14634531 0.68 QDPR (0.37) QDPR
SCHEMBL14634532 0.68 QDPR (0.37) QDPR

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-114450006-A TrkB positive allosteric modulators 斯特拉斯堡大学 2022-05-06 CN disclosed