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Silicate

Silicate

SCHEMBL6839708

CCCCC(O)C(N)(CCCC)CCCC.CCCCC(O)C(N)(CCCC)CCCC.O=[Si](O)O

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 5/20 0.37
▸ CA2 P00918 3/20 0.33
▸ CA1 P00915 2/20 0.33
▸ SMPD1 P17405 2/20 0.32
▸ MAPK1 P28482 1/20 0.31
▸ SLC1A3 P43003 1/20 0.30
▸ SLC1A2 P43004 1/20 0.30
▸ SLC1A1 P43005 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
SCHEMBL3856250 0.90 FDPS (0.39) FDPSCA2CA1SMPD1
Water SCHEMBL1335120 0.88 FDPS (0.38) FDPSCA2CA1SMPD1
SCHEMBL6839709 0.85 FDPS (0.35) FDPSCA2CA1
SCHEMBL11611964 0.82 SPHK1 (0.45) FDPSSMPD1
SCHEMBL5191501 0.82 FDPS (0.39) FDPSCA2CA1SMPD1
Silicate SCHEMBL6847316 0.81 FDPS (0.33) FDPS
Fumaric Acid SCHEMBL18297310 0.81 ACHE (0.46) FDPSCA2CA1MAPK1SLC1A3
Bromide SCHEMBL9716432 0.77 SPHK1 (0.44) FDPSSMPD1
Hydrochloric Acid SCHEMBL9635702 0.77 SPHK1 (0.44) FDPSSMPD1
SCHEMBL8998092 0.76 FDPS (0.40) FDPSCA2CA1SMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040220066-A1 Stripper ROHM AND HAAS ELECTRONIC MATERIALS, L.L.C. 2004-11-04 — — US claimed
US-20040220066-A1 Stripper ROHM AND HAAS ELECTRONIC MATERIALS, L.L.C. 2004-11-04 — — US disclosed