SCHEMBL8958259

SCHEMBL8958259

Cc1cc(NC(=O)Cl)cc(C)c1S(=O)(=O)C[N+](=O)[O-]

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
AKR1B1 P15121 1/20 0.33
POLB P06746 3/20 0.32
GAA P10253 2/20 0.32
ALDH1A1 P00352 4/20 0.32
MAPT P10636 4/20 0.32
ACP1 P24666 1/20 0.32
S1PR4 O95977 1/20 0.31
IDH1 O75874 1/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
PKM P14618 1/20 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
SCHEMBL8958011 0.89 POLB (0.33) RAB9AMEN1KMT2AAKR1B1POLB
SCHEMBL7223994 0.88 POLB (0.36) RAB9AMEN1KMT2AAKR1B1POLB
SCHEMBL7228473 0.88 MAPT (0.40) RAB9AMEN1KMT2APOLBALDH1A1
SCHEMBL7225299 0.87 ALDH1A1 (0.43) MEN1KMT2APOLBGAAALDH1A1
SCHEMBL7223364 0.87 POLB (0.45) RAB9AMEN1KMT2AAKR1B1POLB
SCHEMBL7230766 0.86 POLB (0.42) MEN1KMT2AAKR1B1POLBGAA
SCHEMBL8957820 0.84 THRA (0.38) RAB9AMEN1KMT2AAKR1B1GAA
SCHEMBL8957970 0.83 CA12 (0.41) GAAALDH1A1
SCHEMBL7225323 0.83 HDAC3 (0.42) MEN1KMT2APOLBGAAALDH1A1
SCHEMBL8957815 0.83 ALDH1A1 (0.33) RAB9AMEN1KMT2AAKR1B1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0469889-B1 (p-Carbonylaminophenyl)-sulphonyl-nitromethane derivatives ZENECA LTD (GB) 1996-01-17 EP disclosed
US-5189031-A Inhibitor of enzyme aldose reductase, useful in the treatment of certain peripheral effects of diabetes and galactosemia IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-02-23 US disclosed
US-5110808-A Aldose reductase inhibitors; peripheral effects of diabetes and galactosemia IMPERIAL CHEMICAL INDUSTRIES, PLC (GB) 1992-05-05 US disclosed
EP-0469889-A1 (p-Carbonylaminophenyl)-sulphonyl-nitromethane derivatives ZENECA LIMITED (GB) 1992-02-05 EP disclosed