SCHEMBL13625657

SCHEMBL13625657

COCCCC1=CCC(N)CC1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 1/20 0.33
GABRR1 P24046 1/20 0.32
DRD2 P14416 2/20 0.31
DRD3 P35462 2/20 0.31
TLR7 Q9NYK1 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
SCHEMBL2969313 0.81 SPHK1 (0.35)
SCHEMBL12654324 0.79 ADRA1A (0.33) ADRA1AGABRR1DRD2DRD3
SCHEMBL25738566 0.73
SCHEMBL23408253 0.72 FNTA (0.33)
SCHEMBL18944207 0.72
SCHEMBL21333421 0.70 CES2 (0.32)
SCHEMBL10056227 0.70
SCHEMBL13625397 0.69 MEN1 (0.36)
SCHEMBL13547719 0.69
SCHEMBL24475947 0.69

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-2009136352-A1 ANTI-ANGIOGENIC COMPOUNDS COVX TECHNOLOGIES IRELAND, LTD. (IE) 2009-11-12 WO disclosed