SCHEMBL13326883

SCHEMBL13326883

Cc1cccc(Oc2cccc(Oc3cccc(O)c3)c2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.61
ALDH1A1 P00352 2/20 0.56
L3MBTL1 Q9Y468 2/20 0.49
HTT P42858 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
GAA P10253 1/20 0.49
CYP3A4 P08684 1/20 0.48
LMNA P02545 1/20 0.48
KMT2A Q03164 2/20 0.48
MAPK1 P28482 1/20 0.48
HSD17B1 P14061 1/20 0.45
HSD17B2 P37059 1/20 0.45
AR P10275 2/20 0.45
LYN P07948 1/20 0.45
FFAR1 O14842 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
CHRNB2 P17787 1/20 0.43
CHRNA4 P43681 1/20 0.43
GFER P55789 1/20 0.43

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
SCHEMBL6061453 0.98 ACHE (0.64) ACHEALDH1A1L3MBTL1HTTTDP1
SCHEMBL30358261 0.98 ACHE (0.64) ACHEALDH1A1L3MBTL1HTTTDP1
SCHEMBL5143789 0.87 CYP3A4 (0.55) ACHEALDH1A1TDP1GAACYP3A4
SCHEMBL29719326 0.87 CYP3A4 (0.55) ACHEALDH1A1TDP1GAACYP3A4
SCHEMBL3182473 0.87 CYP3A4 (0.55) ACHEALDH1A1TDP1GAACYP3A4
SCHEMBL1688852 0.87 ALDH1A1 (0.69) ACHEALDH1A1L3MBTL1HTTTDP1
SCHEMBL15247352 0.87 ALDH1A1 (0.53) ACHEALDH1A1L3MBTL1HTTTDP1
SCHEMBL30358251 0.86 ACHE (0.54) ACHEALDH1A1L3MBTL1HTTTDP1
SCHEMBL456868 0.85 ALDH1A1 (0.72) ACHEALDH1A1L3MBTL1HTTTDP1
SCHEMBL29398372 0.85 ALDH1A1 (0.72) ACHEALDH1A1L3MBTL1HTTTDP1

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-7723420-B2 Catalytic hydrosilylation reaction with oligomeric vinyl silane terminated resin based on bisphenol A or F and 1,3-dibromobenzene and tetrakis(dimethylsiloxy)silane crosslinker in presence of a crosslinking catalyst e.g. platinum-vinylmethylsiloxane complex THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2010-05-25 US disclosed
US-20100022693-A1 SYNTHESIS AND POLYMERIZATION OF OLIGOMERIC DIVINYL-TERMINATED AROMATIC ETHER-CONTAINING RESINS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2010-01-28 US disclosed