SCHEMBL7623341

SCHEMBL7623341

CCCCO[Si](C)(OCCCCS(=O)(=O)N=[N+]=[N-])c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 6/20 0.34
ABCC1 P33527 4/20 0.32
ALDH1A1 P00352 4/20 0.32
MGLL Q99685 1/20 0.32
TSHR P16473 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP19A1 P11511 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
HPGD P15428 1/20 0.32
LTA4H P09960 2/20 0.31
HTT P42858 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
PTPN1 P18031 1/20 0.30
PTGS2 P35354 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
SCHEMBL7629808 0.84
SCHEMBL7622816 0.78 TSHR (0.36) ABCB1ABCC1TSHRCYP1A2CYP2C9
SCHEMBL708763 0.77 LTA4H (0.46) ABCB1ALDH1A1MGLLTSHRCYP1A2
SCHEMBL7877836 0.76 ABCB1 (0.34) ABCB1ABCC1ALDH1A1TSHRHTT
SCHEMBL2874011 0.76 LTA4H (0.46) ABCB1ALDH1A1MGLLTSHRCYP1A2
SCHEMBL17391409 0.74 LTA4H (0.44) ABCB1ALDH1A1MGLLTSHRCYP2C9
SCHEMBL7869262 0.74
SCHEMBL7877838 0.72 CA1 (0.30)
SCHEMBL7623208 0.72
SCHEMBL877452 0.71 FAAH (0.46)

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
EP-1218422-A1 AZIDOSILANE-MODIFIED, MOISTURE-CURABLE POLYOLEFIN POLYMERS, PROCESS FOR MAKING, AND ARTICLES OBTAINED THEREFROM THE DOW CHEMICAL COMPANY (US) 2002-07-03 EP disclosed
WO-2001010914-A1 AZIDOSILANE-MODIFIED, MOISTURE-CURABLE POLYOLEFIN POLYMERS, PROCESS FOR MAKING, AND ARTICLES OBTAINED THEREFROM THE DOW CHEMICAL COMPANY (US) 2001-02-15 WO disclosed