SCHEMBL23399762

SCHEMBL23399762

CCCCn1nc(O)c(C(C)(C)C)c1C

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 16/20 0.38
CNR2 P34972 16/20 0.38
NR1H3 Q13133 1/20 0.33
ESR1 P03372 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
SCHEMBL23399579 0.89 CNR1 (0.35) CNR1CNR2ESR1
SCHEMBL23399899 0.83 CNR1 (0.40) CNR1CNR2NR1H3ESR1
SCHEMBL23399023 0.82 LMNA (0.34)
SCHEMBL23400155 0.81 CNR1 (0.35) CNR1CNR2ESR1
SCHEMBL23402515 0.80 CNR1 (0.34) CNR1CNR2ESR1
SCHEMBL23398733 0.80 CNR1 (0.34) CNR1CNR2ESR1
SCHEMBL23399956 0.79 CNR1 (0.34) CNR1CNR2ESR1
SCHEMBL23402270 0.78 NR1H3 (0.37) CNR1CNR2NR1H3ESR1
SCHEMBL23402680 0.77 NR1H3 (0.36) CNR1CNR2NR1H3ESR1
SCHEMBL23403513 0.77 HPGD (0.37) CNR1CNR2NR1H3ESR1

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