SCHEMBL28469461

SCHEMBL28469461

CO[Si](C)(CCCNC1CC1)OC

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 2/20 0.34
GNAO1 P09471 2/20 0.34
GNAI1 P63096 2/20 0.34
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 1/20 0.31
CXCR4 P61073 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
SCHEMBL773610 0.91 CXCR4 (0.41) KDM4EALDH1A1CXCR4
SCHEMBL15360597 0.85 CXCR4 (0.41) KDM4EALDH1A1CXCR4
SCHEMBL30866491 0.80 CXCR4 (0.36) KDM4EALDH1A1CXCR4
SCHEMBL15360513 0.78 KDM4E (0.40) KDM4EALDH1A1CXCR4
SCHEMBL4906974 0.77 CXCR4 (0.37) KDM4EALDH1A1CXCR4
SCHEMBL3693050 0.76
SCHEMBL32678344 0.76 CXCR4 (0.41) KDM4EALDH1A1CXCR4
SCHEMBL8624616 0.74 CXCR4 (0.40) KDM4ECXCR4
SCHEMBL14519144 0.74 KDM4E (0.34) GNAI3GNAO1GNAI1KDM4EALDH1A1
SCHEMBL537901 0.73 CYP2C19 (0.33) ALDH1A1

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
CN-111808550-B Wollastonite for ethylene-vinyl acetate resin hot melt adhesive and preparation method thereof 江西广源化工有限责任公司 2022-01-04 CN claimed
CN-111808550-A Wollastonite for ethylene-vinyl acetate resin hot melt adhesive and preparation method thereof 江西广源化工有限责任公司 2020-10-23 CN claimed
CN-111808550-B Wollastonite for ethylene-vinyl acetate resin hot melt adhesive and preparation method thereof 江西广源化工有限责任公司 2022-01-04 CN disclosed
CN-111808550-A Wollastonite for ethylene-vinyl acetate resin hot melt adhesive and preparation method thereof 江西广源化工有限责任公司 2020-10-23 CN disclosed