SCHEMBL31459935

SCHEMBL31459935

C[Si](C)(C)CCOCn1nc(Br)c2ccc(Cl)cc21

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.37
DGAT1 O75907 3/20 0.37
NPC1 O15118 1/20 0.33
PTPN1 P18031 1/20 0.32
MAPT P10636 1/20 0.31
S1PR4 O95977 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL6486540 0.86 KMO (0.36) KMODGAT1NPC1PTPN1MAPT
SCHEMBL16023365 0.82 NPC1 (0.42) DGAT1NPC1KDM4E
SCHEMBL21055380 0.81 DGAT1 (0.36) DGAT1NPC1MAPT
SCHEMBL31460064 0.81 DGAT1 (0.34) DGAT1NPC1
SCHEMBL21055191 0.80 DGAT1 (0.36) DGAT1NPC1MAPT
SCHEMBL27228071 0.79 CNR2 (0.39) DGAT1NPC1MAPT
SCHEMBL31588698 0.79 DGAT1 (0.37) DGAT1NPC1MAPTKDM4E
SCHEMBL5511811 0.78 NPC1 (0.37) DGAT1NPC1PTPN1MAPT
SCHEMBL29172538 0.78 NPC1 (0.37) DGAT1NPC1MAPTKDM4E
SCHEMBL22013956 0.77 DGAT1 (0.36) DGAT1NPC1MAPT

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
CN-119677749-A Azaquinazoline pan KRAS inhibitors 米拉蒂治疗股份有限公司 2025-03-21 CN disclosed