SCHEMBL23401485

SCHEMBL23401485

CCCc1nn(CC)c(O)c1C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.32
ADORA2B P29275 1/20 0.32
RECQL P46063 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
SCHEMBL23402062 0.89 NPC1 (0.32) ADORA2AADORA2BRECQL
SCHEMBL23398975 0.86 ADORA2A (0.34) ADORA2AADORA2B
SCHEMBL23399085 0.83 GAA (0.39) ADORA2AADORA2BRECQL
SCHEMBL23401662 0.83 NR1H3 (0.34)
SCHEMBL23398493 0.82 HTR2A (0.32)
SCHEMBL23400858 0.82 USP2 (0.34)
SCHEMBL23401518 0.81 NPC1 (0.36) RECQL
SCHEMBL23398936 0.78 USP2 (0.38)
SCHEMBL23401907 0.77 KDM4E (0.37) ADORA2AADORA2B
SCHEMBL23401346 0.76 USP2 (0.31)

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-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed