SCHEMBL31056355

SCHEMBL31056355

C[Si](C)(C)CCOCn1nc(Br)c2cccc(CO)c21

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.34
DGAT1 O75907 3/20 0.34
F2RL1 P55085 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
SCHEMBL24096893 0.84 DGAT1 (0.41) NPC1DGAT1F2RL1
SCHEMBL25770427 0.84 ESR1 (0.40) NPC1DGAT1
SCHEMBL31357995 0.82 NPC1 (0.37) NPC1DGAT1
SCHEMBL31056563 0.81 NPC1 (0.33) NPC1DGAT1
SCHEMBL31055904 0.80 NPC1 (0.36) NPC1DGAT1
SCHEMBL31358117 0.79 NPC1 (0.37) NPC1DGAT1
SCHEMBL31056473 0.78 NPC1 (0.32) NPC1DGAT1
SCHEMBL16023365 0.78 NPC1 (0.42) NPC1DGAT1
SCHEMBL31562253 0.77 DGAT1 (0.33) NPC1DGAT1F2RL1
SCHEMBL31358136 0.76 BRD4 (0.35) NPC1DGAT1

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-2024178390-A1 COVALENT MODIFIERS OF AKT1 AND USES THEREOF TERREMOTO BIOSCIENCES, INC. (US) 2024-08-29 WO disclosed