SCHEMBL23399579

SCHEMBL23399579

CCCn1nc(O)c(C(C)(C)C)c1C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
ADORA2A P29274 1/20 0.33
ADORA2B P29275 1/20 0.33
POLB P06746 1/20 0.33
ESR1 P03372 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
SCHEMBL23399762 0.89 CNR1 (0.38) CNR1CNR2ESR1
SCHEMBL23399023 0.85 LMNA (0.34)
SCHEMBL23403414 0.81 CNR1 (0.33) CNR1CNR2ADORA2AADORA2B
SCHEMBL23399442 0.80 CNR1 (0.32) CNR1CNR2
SCHEMBL23403365 0.79 CNR1 (0.31) CNR1CNR2
SCHEMBL23402839 0.77 CNR1 (0.31) CNR1CNR2
SCHEMBL23402310 0.76 APAF1 (0.33)
SCHEMBL23403490 0.76 ADORA2A (0.37) ADORA2AADORA2BPOLBESR1
SCHEMBL23401839 0.76 CNR1 (0.30) CNR1CNR2
SCHEMBL23400267 0.74 MEN1 (0.30)

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