SCHEMBL6289824

SCHEMBL6289824

CCCCNCCC[Si](OC(C)C)(OC(C)C)OC(C)C

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.41
ADH1B P00325 1/20 0.31
ADH1C P00326 1/20 0.31
ADH1A P07327 1/20 0.31
ADH7 P40394 1/20 0.31
TLR8 Q9NR97 1/20 0.31
TLR7 Q9NYK1 1/20 0.31
HRH4 Q9H3N8 2/20 0.31
HRH3 Q9Y5N1 2/20 0.31
CYP2C19 P33261 2/20 0.31
MEN1 O00255 1/20 0.31
GLA P06280 1/20 0.31
KMT2A Q03164 1/20 0.31
PAOX Q6QHF9 1/20 0.31
ACHE P22303 1/20 0.31
ALOX15 P16050 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
SCHEMBL1777849 0.92 ALDH1A1 (0.31) TSHRALDH1A1CYP2C19MEN1GLA
SCHEMBL21924968 0.90 CYP2C19 (0.35) CYP2C19MEN1GLAKMT2ACYP1A2
SCHEMBL5694461 0.89 TSHR (0.35) TSHRALDH1A1
SCHEMBL581038 0.84 CA12 (0.42) TSHRALDH1A1CYP2C19MEN1KMT2A
SCHEMBL108991 0.83 LMNA (0.33) TSHR
SCHEMBL16268297 0.82 CA12 (0.44) TSHRCYP2C19MEN1KMT2APAOX
SCHEMBL11903804 0.82 CA12 (0.42) TSHRALDH1A1CYP2C19MEN1KMT2A
SCHEMBL2400694 0.81 LMNA (0.36) TSHR
SCHEMBL25263781 0.79 LMNA (0.39) TSHR
SCHEMBL25299366 0.79 LMNA (0.39) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6855792-B2 Cross-linking agents and thermosetting paints DEGUSSA AG (DE) 2005-02-15 US claimed
US-6492482-B2 WEAR AND CHEMICAL RESISTANCE DEGUSS-HUELS AKTIENGESELLSCHAFT (DE) 2002-12-10 US claimed
US-20020103286-A1 Cross-linking agents and thermosetting paints DEGUSSA AG (DE) 2002-08-01 US claimed
EP-1211273-A1 Crosslinker and heatcurable lacquers Degussa AG (DE) 2002-06-05 EP claimed
US-20020042471-A1 Nonaqueous, heat-curable two-component coating DEGUSSA-HUELS AKTIENGESELLSCHAFT (DE) 2002-04-11 US claimed
EP-1193278-A1 Non aqueous, heat curable, two component coating composition Degussa AG (DE) 2002-04-03 EP claimed
US-6855792-B2 Cross-linking agents and thermosetting paints DEGUSSA AG (DE) 2005-02-15 US disclosed
US-6492482-B2 WEAR AND CHEMICAL RESISTANCE DEGUSS-HUELS AKTIENGESELLSCHAFT (DE) 2002-12-10 US disclosed
US-20020103286-A1 Cross-linking agents and thermosetting paints DEGUSSA AG (DE) 2002-08-01 US disclosed
EP-1211273-A1 Crosslinker and heatcurable lacquers Degussa AG (DE) 2002-06-05 EP disclosed
US-20020042471-A1 Nonaqueous, heat-curable two-component coating DEGUSSA-HUELS AKTIENGESELLSCHAFT (DE) 2002-04-11 US disclosed
EP-1193278-A1 Non aqueous, heat curable, two component coating composition Degussa AG (DE) 2002-04-03 EP disclosed