SCHEMBL9740667

SCHEMBL9740667

COc1ccccc1S(=O)(=O)C[N+](=O)[O-]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.49
ALDH1A1 P00352 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 1/20 0.41
AMY1A P0DUB6 1/20 0.41
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KMT2A Q03164 2/20 0.40
NFE2L2 Q16236 3/20 0.39
KCNH2 Q12809 1/20 0.39
MEN1 O00255 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL9711264 0.84 ALDH1A1 (0.47) ALDH1A1L3MBTL1LMNANPSR1
SCHEMBL9704151 0.79 HTR6 (0.55) HTR6ALDH1A1TDP1KMT2ANFE2L2
SCHEMBL13370774 0.78 HTR6 (0.58) HTR6KMT2ANFE2L2KCNH2CA12
SCHEMBL4247206 0.78 HTR6 (0.58) HTR6KMT2ANFE2L2KCNH2CA12
SCHEMBL9652718 0.77 ALDH1A1 (0.43) ALDH1A1TDP1KMT2ANFE2L2MEN1
SCHEMBL7525497 0.77 SMN1; SMN2 (0.48) ALDH1A1LMNAAMY1ANPSR1KMT2A
SCHEMBL9350111 0.76 MEN1 (0.48) ALDH1A1LMNAMAPTNPSR1KMT2A
SCHEMBL9711172 0.75 CA1 (0.50) HTR6ALDH1A1KMT2ANFE2L2MEN1
SCHEMBL9740686 0.74 HSD11B1 (0.41) ALDH1A1L3MBTL1MAPTKMT2ANFE2L2
SCHEMBL9740023 0.74 PLCG1 (0.60) TDP1L3MBTL1MAPTKMT2AMEN1

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-5153227-A Treatment of diabetes and galactosemia complications IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-10-06 US disclosed