SCHEMBL19326751

SCHEMBL19326751

CO[Si](CCCNC1CCCCC1)(OC)OC.CO[Si](CCCNCCN)(OC)OC

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CXCR4 P61073 14/20 0.41
CXCL12 P48061 1/20 0.41
KDM4E B2RXH2 2/20 0.36
SQLE Q14534 1/20 0.36
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL4906974 0.93 CXCR4 (0.37) CXCR4CXCL12KDM4ESQLEALDH1A1
SCHEMBL4906971 0.90 CXCR4 (0.35) CXCR4CXCL12KDM4ESQLE
SCHEMBL14519144 0.89 KDM4E (0.34) CXCR4KDM4ESQLEALDH1A1
SCHEMBL56457 0.89 KDM4E (0.42) CXCR4CXCL12KDM4EALDH1A1
SCHEMBL15360533 0.84 CXCR4 (0.42) CXCR4CXCL12KDM4EALDH1A1
SCHEMBL19549 0.80 CA12 (0.48) KDM4EALDH1A1
SCHEMBL5711364 0.80 CA12 (0.48) KDM4EALDH1A1
SCHEMBL5891867 0.80 CA12 (0.48) KDM4EALDH1A1
SCHEMBL556033 0.79 KDM4E (0.45) CXCR4KDM4EALDH1A1
SCHEMBL730245 0.79 CXCR4 (0.37) CXCR4CXCL12KDM4EALDH1A1

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-2145928-B1 Dispersion made of hydrophobic silicon dioxide particles and granulate made from same EVONIK DEGUSSA GMBH (DE) 2017-09-13 EP disclosed