SCHEMBL19087688

SCHEMBL19087688

C=C1CC[C@H]2CN(CC)C(=O)C(=C)N12

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL19087865 0.72
SCHEMBL10506824 0.69 NOTUM (0.34)
SCHEMBL13284657 0.62 PER2 (0.30)
SCHEMBL21506136 0.62
SCHEMBL508107 0.57
SCHEMBL14829141 0.56 ALDH1A1 (0.44) GAAL3MBTL1
SCHEMBL22210754 0.56
SCHEMBL18655978 0.55 FGFR1 (0.36) GAA
SCHEMBL13501654 0.55
SCHEMBL12032985 0.55 NOTUM (0.33)

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-2017113288-A1 FUSED TRICYCLIC HETEROCYCLIC COMPOUNDS AS HIV INTEGRASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2017-07-06 WO disclosed