SCHEMBL13429652

SCHEMBL13429652

COC(=O)c1cc(C2(c3ccc(O)c(C(=O)OC)c3)c3cc(Br)ccc3-c3ccc([Si](OC)(OC)OC)cc32)ccc1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA7 P43166 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ CA14 Q9ULX7 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ SLC6A3 Q01959 1/20 0.35
▸ PTGS2 P35354 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ NR4A2 P43354 1/20 0.34
▸ CES2 O00748 1/20 0.33
▸ GALR3 O60755 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ LMNA P02545 1/20 0.33

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
SCHEMBL13429662 0.88 HSD17B10 (0.38) SMN1; SMN2SLC6A3L3MBTL1NR4A2CYP1A2
SCHEMBL13429588 0.84 CA12 (0.43) CA12CA1CA2CA7CA9
SCHEMBL13429819 0.84 CA12 (0.43) CA12CA1CA2CA7CA9
SCHEMBL16330271 0.83 CA12 (0.41) CA12CA1CA2CA7CA9
SCHEMBL13429661 0.82 POLB (0.38) SMN1; SMN2CYP1A2CYP2C9HPGDCYP2C19
SCHEMBL13429648 0.81 PTPN11 (0.37) SMN1; SMN2SLC6A3LMNAHSD17B10GAA
SCHEMBL15443732 0.81 SMN1; SMN2 (0.41) CA12CA1CA2CA7CA9
SCHEMBL13429536 0.78 HIF1A (0.38) CA12CA1CA2CA7CA9
SCHEMBL13430082 0.78 CA12 (0.36) CA12CA1CA2CA7CA9
SCHEMBL812488 0.78 CA12 (0.51) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100069603-A1 METHOD FOR PRODUCING STRUCTURE WHEREIN AROMATIC POLYMER IS BONDED TO BASE, STRUCTURE HAVING AROMATIC POLYMER CHAIN BONDED TO CONDUCTIVE BASE, AND ELECTRONIC DEVICE COMPRISING THE STRUCTURE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-18 — — US disclosed
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