SCHEMBL31662301

SCHEMBL31662301

COC(=O)c1cc2cnn(COCC[Si](C)(C)C)c2cc1Br

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.37
MEN1 O00255 2/20 0.36
KDM4E B2RXH2 2/20 0.36
GAA P10253 1/20 0.36
TSHR P16473 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HSD17B10 Q99714 1/20 0.36
DGAT1 O75907 4/20 0.33
NPC1 O15118 1/20 0.32
CYP1A2 P05177 3/20 0.32
CYP2C19 P33261 3/20 0.32
IRAK4 Q9NWZ3 1/20 0.32
CYP3A4 P08684 1/20 0.32
PKM P14618 1/20 0.32
CYP2C9 P11712 1/20 0.32
KMO O15229 1/20 0.32
MAPT P10636 2/20 0.32
KLKB1 P03952 1/20 0.31
SPR P35270 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL30286434 0.96 KMT2A (0.36) KMT2AMEN1KDM4EGAATSHR
SCHEMBL21988942 0.96 KMT2A (0.36) KMT2AMEN1KDM4EGAATSHR
SCHEMBL22045916 0.84 KMT2A (0.39) KMT2AMEN1KDM4EGAATSHR
SCHEMBL21989101 0.84 DGAT1 (0.34) DGAT1NPC1KMOMAPTALDH1A1
SCHEMBL21988831 0.84 HSD17B10 (0.37) TSHRHSD17B10DGAT1NPC1KMO
SCHEMBL25807918 0.81 KMT2A (0.35) KMT2AMEN1KDM4EGAATSHR
SCHEMBL31662536 0.81 KMT2A (0.48) KMT2AMEN1KDM4EGAATSHR
SCHEMBL15917685 0.80 DGAT1 (0.35) KMT2AMEN1KDM4EGAATSHR
SCHEMBL20604807 0.80 HSD17B10 (0.34) KMT2AMEN1KDM4EGAATSHR
SCHEMBL21796612 0.80 DGAT1 (0.37) DGAT1

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-2025149545-A1 HETEROARYLPHENYL ETHER DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2025-07-17 WO disclosed