SCHEMBL4392522

SCHEMBL4392522

CO[C]c1cccc(O[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA12 O43570 6/20 0.40
CA1 P00915 6/20 0.40
CA9 Q16790 6/20 0.40
PREP P48147 2/20 0.38
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
GRM5 P41594 3/20 0.34
CA2 P00918 2/20 0.31

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
SCHEMBL1396396 0.82 CA12 (0.41) CA12CA1CA9PREPHSP90AA1
SCHEMBL3287158 0.82 CA12 (0.41) CA12CA1CA9
SCHEMBL7706827 0.80 CA1 (0.50) CA12CA1CA9PREPHSP90AA1
SCHEMBL5292779 0.78 ACHE (0.45) CA12CA1CA9CA2
SCHEMBL6810932 0.76 HAO1 (0.38) CA12CA1CA9PREPHSP90AA1
SCHEMBL3182564 0.75 CA12 (0.46) CA12CA1CA9PREPHSP90AA1
SCHEMBL8055180 0.75 ACHE (0.50) CA12CA1CA9GRM5CA2
SCHEMBL30940206 0.75 CA12 (0.43) CA12CA1CA9PREPHSP90AA1
SCHEMBL4004898 0.74 CYP3A4 (0.47) CA12CA1CA9PREPHSP90AA1
SCHEMBL2329760 0.74 ACHE (0.50) CA12CA1CA9PREPHSP90AA1

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-1112274-B1 CHEMILUMINESCENT 1,2-DIOXETANES GIRI BRIJ P (US) 2009-12-09 EP disclosed
EP-0254051-B1 Chemiluminescent 1,2-dioxetane compounds UNIV WAYNE STATE (US) 1994-08-31 EP disclosed