SCHEMBL23399493

SCHEMBL23399493

Cc1nn(C)c(C(C)(C)C)c1O

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.31
ADORA2B P29275 1/20 0.31

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
SCHEMBL12138138 0.79 ADORA2A (0.32) ADORA2AADORA2B
SCHEMBL23403251 0.77 PKM (0.36)
SCHEMBL23399892 0.76 HPGD (0.33)
SCHEMBL13990554 0.74 SMN1; SMN2 (0.39) ADORA2AADORA2B
SCHEMBL23398445 0.74 ADORA2A (0.41) ADORA2AADORA2B
SCHEMBL12733611 0.73 KDM4E (0.39) ADORA2AADORA2B
SCHEMBL21721443 0.73 ADORA2A (0.31) ADORA2AADORA2B
SCHEMBL17045634 0.73 PKM (0.34) ADORA2AADORA2B
SCHEMBL23401212 0.73
SCHEMBL23402535 0.73

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