SCHEMBL26458075

SCHEMBL26458075

CCOC(=O)C(CC)NCCC[Si](OCC)(OCC)OCC

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.35
POLB P06746 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
CAD P27708 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HTT P42858 1/20 0.31
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
TSHR P16473 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
SCHEMBL17505034 0.87 SMN1; SMN2 (0.35) KMT2APOLBSMN1; SMN2CADL3MBTL1
SCHEMBL1931815 0.87 KMT2A (0.38) KMT2APOLBSMN1; SMN2CADL3MBTL1
SCHEMBL1931813 0.87 KMT2A (0.38) KMT2APOLBSMN1; SMN2CADL3MBTL1
SCHEMBL15999304 0.80 GAA (0.34) KMT2APOLBL3MBTL1MGAMGAA
SCHEMBL15493555 0.79 CAD (0.43) KMT2APOLBSMN1; SMN2CADL3MBTL1
SCHEMBL26372535 0.78 KMT2A (0.35) KMT2APOLBL3MBTL1CYP1A2CYP2C9
SCHEMBL4447146 0.78 TSHR (0.31) TSHR
SCHEMBL4447143 0.78 TSHR (0.31) TSHR
SCHEMBL1367286 0.77 EPHX2 (0.34) TSHR
SCHEMBL1367282 0.77 EPHX2 (0.34) TSHR

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
US-20230138639-A1 PROCESS FOR PREPARING SILYLATED IONIC COPOLYURETHANES WITH IMPROVED ELASTICITY BOSTIK SA (FR) 2023-05-04 US disclosed