SCHEMBL4066428

SCHEMBL4066428

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nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.36
ADORA3 P0DMS8 18/20 0.34
ADORA2A P29274 2/20 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
SCHEMBL4066424 1.00 SSTR4 (0.36) SSTR4ADORA3ADORA2A
SCHEMBL4066336 0.80 PSEN1 (0.32) ADORA3
SCHEMBL4066331 0.80 PSEN1 (0.32) ADORA3
SCHEMBL3190228 0.79 KDM4E (0.34) ADORA3
SCHEMBL3190237 0.79 KDM4E (0.34) ADORA3
SCHEMBL4066590 0.77 ADORA3 (0.35) ADORA3
SCHEMBL4066596 0.77 ADORA3 (0.35) ADORA3
SCHEMBL4061527 0.77 ALDH1A3 (0.45) ADORA3ADORA2A
SCHEMBL4062013 0.77 HTR4 (0.37) ADORA3
SCHEMBL4062015 0.77 HTR4 (0.37) ADORA3

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
EP-2041153-B1 NEW 5-THIOXYLOPYRANOSE DERIVATIVES FOURNIER LAB SA (FR) 2009-10-21 EP disclosed