Sugi Predict

Sugi Predict / Compounds / SCHEMBL6545080

SCHEMBL6545080

SCHEMBL6545080

CC(C)(C)[Si](C)(C)OC(=O)CCCC(=O)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ DGKA P23743 1/20 0.30
▸ RECQL P46063 1/20 0.30
▸ CYP1A2 P05177 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
SCHEMBL6545278 0.91 TSHR (0.38) TSHR
SCHEMBL7046887 0.86 DGKA (0.50) TSHRALDH1A1LMNADGKA
SCHEMBL31285293 0.86 DGKA (0.50) TSHRALDH1A1LMNADGKA
SCHEMBL1595383 0.86 TSHR (0.44) TSHRALDH1A1LMNA
SCHEMBL4863534 0.86 TSHR (0.31) TSHRALDH1A1LMNA
SCHEMBL4936173 0.86 DGKA (0.50) TSHRALDH1A1LMNADGKA
SCHEMBL7417842 0.86 DUT (0.37) TSHR
SCHEMBL8864847 0.85 DUT (0.36) TSHRALDH1A1LMNADGKA
SCHEMBL6309457 0.84 ALDH1A1 (0.46) TSHRALDH1A1LMNA
SCHEMBL9626170 0.83 ALDH1A1 (0.40) TSHRALDH1A1LMNADGKARECQL

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
WO-2004005302-A1 PROCESS FOR THE PREPARATION OF ACYLOXYSILANES SIGMA COATINGS B.V. (NL) 2004-01-15 — — WO disclosed
EP-1378514-A1 Process for the preparation of acyloxysilanes SigmaKalon Group B.V. (NL) 2004-01-07 — — EP disclosed