SCHEMBL2963233

SCHEMBL2963233

O=C1CCC(=O)N1OS(=O)(=O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PARL Q9H300 2/20 0.55
KMT2A Q03164 5/20 0.51
MEN1 O00255 4/20 0.51
ALDH1A1 P00352 2/20 0.51
LMNA P02545 2/20 0.49
PKM P14618 1/20 0.48
POLB P06746 2/20 0.47
ACHE P22303 1/20 0.47
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
GSK3B P49841 1/20 0.46
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
MMP1 P03956 1/20 0.45
MMP2 P08253 1/20 0.45
MMP9 P14780 1/20 0.45
MMP8 P22894 1/20 0.45
MMP13 P45452 1/20 0.45

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
SCHEMBL2965398 0.79 POLB (0.46) PARLKMT2AMEN1ALDH1A1LMNA
SCHEMBL11134429 0.76 KMT2A (0.59) KMT2AMEN1ALDH1A1LMNAPOLB
SCHEMBL999377 0.76 KMT2A (0.68) KMT2AMEN1ALDH1A1PKMPOLB
SCHEMBL8014864 0.76 KMT2A (0.68) KMT2AMEN1ALDH1A1PKMPOLB
SCHEMBL2957966 0.75 PARL (0.62) PARLKMT2AMEN1ALDH1A1LMNA
SCHEMBL2962362 0.75 PARL (0.62) PARLKMT2AMEN1ALDH1A1LMNA
SCHEMBL12339094 0.73 PARL (0.81) PARLKMT2AMEN1ALDH1A1LMNA
SCHEMBL7973267 0.73 PARL (0.65) PARLKMT2AMEN1ALDH1A1LMNA
SCHEMBL65216 0.73 PARL (0.58) PARLKMT2AMEN1ALDH1A1HPGD
SCHEMBL7161148 0.73 PARL (0.58) PARLKMT2AMEN1ALDH1A1LMNA

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-7759045-B2 Chemically amplified positive resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-07-20 US disclosed
US-20090004601-A1 Chemically amplified positive resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-01 US disclosed