SCHEMBL9876701

SCHEMBL9876701

CCO[Si](CCCN=Cc1cccc([N+](=O)[O-])c1)(OCC)OCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
KMT2A Q03164 4/20 0.48
MEN1 O00255 2/20 0.48
POLB P06746 2/20 0.47
ALDH1A1 P00352 7/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
HTT P42858 3/20 0.46
AMY1A P0DUB6 1/20 0.46
HPGD P15428 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
USP2 O75604 1/20 0.46
XBP1 P17861 1/20 0.46
RAB9A P51151 6/20 0.44
NPC1 O15118 5/20 0.44
GLO1 Q04760 1/20 0.44
MAPT P10636 5/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
CASP3 P42574 1/20 0.43
SENP7 Q9BQF6 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
SCHEMBL9877569 0.85 PTGS2 (0.45) KMT2AMEN1ALDH1A1HTTAMY1A
SCHEMBL9181666 0.83 ALDH1A1 (0.58) CA1CA2KMT2AMEN1POLB
SCHEMBL9181669 0.83 ALDH1A1 (0.58) CA1CA2KMT2AMEN1POLB
SCHEMBL10663163 0.83 ALDH1A1 (0.58) CA1CA2KMT2AMEN1POLB
SCHEMBL9698864 0.82 CA1 (0.61) CA1CA2KMT2AMEN1POLB
SCHEMBL9698869 0.82 CA1 (0.61) CA1CA2KMT2AMEN1POLB
SCHEMBL4900542 0.80 KMT2A (0.66) CA1CA2KMT2AMEN1POLB
SCHEMBL4900549 0.80 KMT2A (0.66) CA1CA2KMT2AMEN1POLB
SCHEMBL13322143 0.78 MAPT (0.41) KMT2AMEN1POLBALDH1A1HTT
SCHEMBL9876664 0.78 CA12 (0.67) KMT2AMEN1ALDH1A1L3MBTL1NPSR1

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
EP-0427070-A2 Compositions of polyphenylenesulfides, glass fibers and nitrogroup containing silanes BAYER AG (DE) 1991-05-15 EP disclosed