SCHEMBL13787490

SCHEMBL13787490

CC(C)(C)OC(=O)N1CC(O[Si](C)(C)C(C)(C)C)CN1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NR1H2 P55055 1/20 0.33
CHRM2 P08172 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
RECQL P46063 1/20 0.31
PPM1D O15297 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
SCHEMBL4450044 0.84 PPM1D (0.34) PPM1D
SCHEMBL5549338 0.78
SCHEMBL15152157 0.77 NR1H2 (0.40) USP2SMN1; SMN2NR1H2CHRM2CHRM1
SCHEMBL13167071 0.77 NR1H2 (0.46) USP2SMN1; SMN2NR1H2RECQL
SCHEMBL20722519 0.76 USP2 (0.39) USP2SMN1; SMN2NR1H2RECQL
SCHEMBL30644078 0.73 NR1H2 (0.38) USP2SMN1; SMN2NR1H2CHRM2CHRM1
SCHEMBL15074463 0.73 CHRM2 (0.45) USP2SMN1; SMN2NR1H2CHRM2CHRM1
SCHEMBL13787489 0.73 CHRM2 (0.45) USP2SMN1; SMN2NR1H2CHRM2CHRM1
SCHEMBL4155674 0.72 PIK3CD (0.46) USP2SMN1; SMN2RECQL
SCHEMBL4155678 0.72 PIK3CD (0.46) USP2SMN1; SMN2RECQL

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020198058-A1 INHIBITORS OF RAF KINASES KINNATE BIOPHARMA INC. (US) 2020-10-01 WO disclosed
US-7557102-B2 Pyrazolidine-1,2-dicarboxyldiphenylamide derivatives as coagulation factor Xa inhibitors for the treatment of thromboses MERCK PATENT GMBH (DE) 2009-07-07 US disclosed