SCHEMBL25811478

SCHEMBL25811478

CC(C)(C)OC(=O)NC(C)([SiH3])C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSK P43235 8/20 0.41
CTSS P25774 8/20 0.41
CTSL P07711 2/20 0.39
CTSB P07858 2/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.37
CA12 O43570 1/20 0.37
CA14 Q9ULX7 1/20 0.37
DGAT1 O75907 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
BTK Q06187 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36

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
SCHEMBL2512445 0.79 MEN1 (0.40) CTSKCTSSCTSLCTSBMEN1
SCHEMBL76832 0.79 KDM4C (0.41) CTSKCTSSCTSLCTSBMEN1
SCHEMBL25229366 0.79 MEN1 (0.44) CTSKCTSSCTSLCTSBMEN1
SCHEMBL8144616 0.77 MEN1 (0.39) CTSKCTSSCTSLCTSBMEN1
SCHEMBL21834933 0.77 KDM4C (0.39) CTSKCTSSCTSLCTSBMEN1
SCHEMBL16296168 0.77 KDM4C (0.39) CTSKCTSSCTSLCTSBMEN1
SCHEMBL1234633 0.76 CA1 (0.42) CTSKMEN1GAAKMT2ATDP1
SCHEMBL22577405 0.76 MEN1 (0.38) CTSKCTSSCTSLCTSBMEN1
SCHEMBL13744302 0.76 MEN1 (0.38) CTSKCTSSCTSLCTSBMEN1
SCHEMBL20776954 0.76 MEN1 (0.38) CTSKCTSSCTSLCTSBMEN1

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-2023129667-A1 PYRAZINE COMPOUNDS AS INHIBITORS OF FLT3 BIOMEA FUSION, INC. (US) 2023-07-06 WO disclosed