SCHEMBL8866835

SCHEMBL8866835

C1CNC2=C(C1)CCCN2

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OR51E2 Q9H255 1/20 0.43
CRBN Q96SW2 2/20 0.35
FKBP5 Q13451 1/20 0.35
UHRF1 Q96T88 1/20 0.32

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
SCHEMBL22908208 0.85
SCHEMBL13812990 0.79
SCHEMBL23794186 0.75 OR51E2 (0.46) OR51E2CRBNFKBP5
SCHEMBL16738070 0.70 OR51E2 (0.37) OR51E2CRBNFKBP5
SCHEMBL5056719 0.69 OR51E2 (0.39) OR51E2CRBNFKBP5
SCHEMBL20100268 0.69
SCHEMBL19689034 0.69 OR51E2 (0.39) OR51E2CRBNFKBP5UHRF1
SCHEMBL2228088 0.65
SCHEMBL8866832 0.65 OR51E2 (0.47) OR51E2CRBNFKBP5UHRF1
SCHEMBL24497344 0.64 OR51E2 (0.35) OR51E2

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
US-5700941-A Octahydronaphthyridine derivatives MERCK, SHARP & DOHME, LTD. (GB) 1997-12-23 US disclosed