SCHEMBL2434849

SCHEMBL2434849

CC(C)(C)OC(=O)N1CC[C@@H](O)C1O[Si](C)(C)C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
USP2 O75604 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 2/20 0.36
RECQL P46063 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
GRM5 P41594 1/20 0.34

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
SCHEMBL2433244 0.78 CHRM2 (0.46) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL2023504 0.78 HSD17B10 (0.40) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL7327626 0.78 HSD17B10 (0.40) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL2023499 0.78 HSD17B10 (0.40) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL7327622 0.78 HSD17B10 (0.40) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL6095020 0.78 HSD17B10 (0.40) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL4474052 0.77 PIK3CD (0.40) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL1446375 0.77 ALDH1A1 (0.39) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL1446373 0.77 ALDH1A1 (0.39) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL4165716 0.75 HSD17B10 (0.45) USP2SMN1; SMN2ALDH1A1RECQLHSD17B10

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
EP-1346982-B1 VLA-4 INHIBITORS DAIICHI SEIYAKU CO (JP) 2011-09-14 EP disclosed