SCHEMBL31073262

SCHEMBL31073262

CC(C)(C)[Si](C)(C)OCc1ccc(CC2CCN(c3ccc(N)nc3)CC2)cc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.36
RPS6KB1 P23443 4/20 0.36
PIK3CA P42336 5/20 0.35
MTOR P42345 5/20 0.35
HRH4 Q9H3N8 1/20 0.34
MAPT P10636 2/20 0.34
LMNA P02545 1/20 0.34
AOC3 Q16853 1/20 0.33
TSHR P16473 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TP53 P04637 1/20 0.33
GPR119 Q8TDV5 1/20 0.33

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
SCHEMBL31073006 0.95 HRH3 (0.38) HRH3RPS6KB1PIK3CAMTORHRH4
SCHEMBL31073153 0.88 DHFR (0.34) PIK3CAMTORAOC3GPR119
SCHEMBL31072986 0.86 KCNH2 (0.41) HRH3
SCHEMBL31073285 0.85 GCK (0.38) HRH3RPS6KB1PIK3CAMTORHRH4
SCHEMBL31073195 0.84 PIK3CA (0.40) HRH3PIK3CAMTORHRH4
SCHEMBL31073086 0.84 TRPC6 (0.36)
SCHEMBL31073373 0.83 POLB (0.48) HRH3MAPTSMN1; SMN2GPR119
SCHEMBL31073430 0.83 POLB (0.48) HRH3MAPTSMN1; SMN2GPR119
SCHEMBL31073002 0.82 GCK (0.38) HRH3AOC3GPR119
SCHEMBL31073142 0.82 CHRNB2 (0.33) GPR119

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