SCHEMBL31073153

SCHEMBL31073153

CC(C)(C)[Si](C)(C)OCc1ccc(C2CCN(c3ccc(N)nc3)CC2)cc1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DHFR P00374 2/20 0.34
DGAT1 O75907 2/20 0.33
PIK3CA P42336 4/20 0.33
MTOR P42345 4/20 0.33
GPR119 Q8TDV5 1/20 0.32
GCK P35557 1/20 0.32
GCKR Q14397 1/20 0.32
DRD2 P14416 2/20 0.32
DRD3 P35462 2/20 0.32
DRD4 P21917 1/20 0.32
TRPC6 Q9Y210 3/20 0.32
AOC3 Q16853 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
SCHEMBL31073086 0.94 TRPC6 (0.36) DHFRDGAT1GCKGCKRDRD2
SCHEMBL31073024 0.88 TRPC6 (0.37) PIK3CAMTORDRD2DRD3DRD4
SCHEMBL31073262 0.88 HRH3 (0.36) PIK3CAMTORGPR119AOC3
SCHEMBL31072986 0.85 KCNH2 (0.41)
SCHEMBL31073006 0.85 HRH3 (0.38) PIK3CAMTORGCKGCKR
SCHEMBL31073285 0.84 GCK (0.38) DHFRPIK3CAMTORGCKGCKR
SCHEMBL31073333 0.83 DGAT1 (0.35) DGAT1DRD2DRD3DRD4TRPC6
SCHEMBL31072985 0.83 CCR5 (0.40) DRD2DRD3DRD4TRPC6
SCHEMBL31073487 0.83 POLB (0.47) GPR119
SCHEMBL31073195 0.81 PIK3CA (0.40) PIK3CAMTORGCKGCKRTRPC6

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-2024173646-A1 CYCLIN-DEPENDENT KINASE DEGRADING COMPOUNDS INNOVO THERAPEUTICS, INC. (US) 2024-08-22 WO disclosed