SCHEMBL23399962

SCHEMBL23399962

CCCc1nn(CCC)c(C(C)(C)C)c1O

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.32
CNR2 P34972 4/20 0.32
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL23401321 0.92 CNR1 (0.36) CNR1CNR2
SCHEMBL23402720 0.90 CNR1 (0.39) CNR1CNR2
SCHEMBL23401966 0.88
SCHEMBL23402574 0.88 CNR1 (0.35) CNR1CNR2
SCHEMBL23401445 0.85 CNR1 (0.39) CNR1CNR2LMNA
SCHEMBL23403252 0.82 LMNA (0.37) LMNAMAPTATML3MBTL1
SCHEMBL23399804 0.82 CNR1 (0.30) CNR1CNR2
SCHEMBL23399859 0.82 HTR2A (0.30)
SCHEMBL23402033 0.79 CNR1 (0.33) CNR1CNR2
SCHEMBL23398445 0.79 ADORA2A (0.41) CNR1CNR2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4326783-A1 POLYMERIZATION INHIBITORS BASF SE (DE) 2024-02-28 EP disclosed
WO-2022223336-A1 POLYMERIZATION INHIBITORS BASF SE (DE) 2022-10-27 WO disclosed
EP-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed