SCHEMBL28804688

SCHEMBL28804688

CC(C[C]1C=Cc2cc3c(cc21)CC(C)(C)C3)c1ccccc1.[Hf]

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.33
MAOB P27338 3/20 0.33
NISCH Q9Y2I1 3/20 0.33
RIPK1 Q13546 1/20 0.32
TAAR1 Q96RJ0 2/20 0.32
TRPA1 O75762 1/20 0.31
NR3C2 P08235 1/20 0.30

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
SCHEMBL23273299 0.99 MAOA (0.33) MAOAMAOBNISCHRIPK1TAAR1
SCHEMBL28804543 0.88 RIPK1 (0.33) MAOAMAOBNISCHRIPK1TAAR1
SCHEMBL22983230 0.86 RIPK1 (0.34) MAOAMAOBNISCHRIPK1TAAR1
SCHEMBL28804643 0.84 MAOA (0.34) MAOAMAOBNISCHRIPK1TAAR1
SCHEMBL22982019 0.83 MAOA (0.35) MAOAMAOBNISCHRIPK1TAAR1
SCHEMBL23273332 0.83 MAOA (0.35) MAOAMAOBNISCHRIPK1TAAR1
SCHEMBL28946918 0.82
SCHEMBL28804636 0.79 ALDH1A1 (0.33) MAOAMAOBTAAR1
SCHEMBL28804563 0.79 LMNA (0.36)
SCHEMBL23273337 0.77 ALDH1A1 (0.34) MAOAMAOBTAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114845980-A Dimer-selective metallocene catalyst, non-aromatic hydrocarbon soluble activator and method for preparing poly alpha-olefin oligomer using the same 埃克森美孚化学专利公司 2022-08-02 CN claimed
CN-114845980-A Dimer-selective metallocene catalyst, non-aromatic hydrocarbon soluble activator and method for preparing poly alpha-olefin oligomer using the same 埃克森美孚化学专利公司 2022-08-02 CN disclosed