SCHEMBL4632552

SCHEMBL4632552

CCO[Si](CCCN[C@@H](CC(N)=O)C(=O)O)(OCC)OCC

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 3/20 0.35
TSHR P16473 1/20 0.32
ALDH1A1 P00352 1/20 0.32
RAB9A P51151 1/20 0.32
FOLH1 Q04609 1/20 0.32
NOD1 Q9Y239 1/20 0.32
ITGB2 P05107 1/20 0.31
ICAM1 P05362 1/20 0.31
ITGAL P20701 1/20 0.31
MAPK1 P28482 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
SCHEMBL1367286 0.88 EPHX2 (0.34) TSHRNOD1MAPK1
SCHEMBL1367282 0.88 EPHX2 (0.34) TSHRNOD1MAPK1
SCHEMBL15011355 0.85 ECE1 (0.36) ECE1TSHRALDH1A1RAB9AFOLH1
SCHEMBL38659303 0.81 TLR2 (0.40) FOLH1NOD1
SCHEMBL1985636 0.78 ECE1 (0.35) ECE1TSHRALDH1A1RAB9AFOLH1
SCHEMBL28909305 0.78 ALOX15 (0.47) ECE1NOD1ITGB2ICAM1ITGAL
SCHEMBL28909304 0.78 ALOX15 (0.47) ECE1NOD1ITGB2ICAM1ITGAL
SCHEMBL28658877 0.77 TSHR (0.33) TSHRALDH1A1
SCHEMBL17505034 0.77 SMN1; SMN2 (0.35)
SCHEMBL4285748 0.77 NOD1 (0.48) ECE1NOD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3224294-A1 FAST-CURING COMPOSITION CONTAINING SILANE GROUPS Sika Technology AG (CH) 2017-10-04 EP disclosed
WO-2016083309-A1 FAST-CURING COMPOSITION CONTAINING SILANE GROUPS SIKA TECHNOLOGY AG (CH) 2016-06-02 WO disclosed
EP-1924623-A1 PREPOLYMERS COMPRISING ALKOXYSILANE AND SPECIAL ALLOPHANATE AND/OR BIURET GROUPS, A METHOD FOR THEIR PREPARATION AND USE THEREOF Bayer MaterialScience AG (DE) 2008-05-28 EP disclosed
WO-2007025667-A1 PREPOLYMERS COMPRISING ALKOXYSILANE AND SPECIAL ALLOPHANATE AND/OR BIURET GROUPS, A METHOD FOR THEIR PREPARATION AND USE THEREOF BAYER MATERIALSCIENCE AG (DE) 2007-03-08 WO disclosed