SCHEMBL31342891

SCHEMBL31342891

CC(C)(C)OC(=O)N1CCC(N(c2ccc(C(F)(F)F)cc2)c2cnccc2Cl)CC1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 8/20 0.53
GPR119 Q8TDV5 9/20 0.49
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
NR3C1 P04150 1/20 0.44

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
SCHEMBL31342904 0.89 GPR119 (0.45) CYP3A4GPR119MEN1KMT2A
SCHEMBL31342880 0.88 CYP3A4 (0.52) CYP3A4GPR119MEN1KMT2A
SCHEMBL31342921 0.88 CYP3A4 (0.52) CYP3A4GPR119MEN1KMT2A
SCHEMBL25598476 0.83 CYP3A4 (0.76) CYP3A4
SCHEMBL31342885 0.80 MEN1 (0.52) CYP3A4GPR119MEN1KMT2A
SCHEMBL18263756 0.79 MEN1 (0.60) CYP3A4GPR119MEN1KMT2A
SCHEMBL31343048 0.78 GPR119 (0.44) CYP3A4GPR119MEN1KMT2A
SCHEMBL31342997 0.78 GPR119 (0.44) CYP3A4GPR119MEN1KMT2A
SCHEMBL31342989 0.78 GPR119 (0.44) CYP3A4GPR119MEN1KMT2A
SCHEMBL31343070 0.77 GPR119 (0.49) CYP3A4GPR119MEN1KMT2A

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
WO-2025049495-A1 TERTIARY PYRIDYL AMINE MODULATORS OF CHOLESTEROL BIOSYNTHESIS AND THEIR USE FOR PROMOTING REMYLINATION GENENTECH, INC. (US) 2025-03-06 WO disclosed