SCHEMBL10548910

SCHEMBL10548910

NNC(=O)c1ccccc1S[N+](=O)[O-]

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CTSD P07339 2/20 0.58
▸ SLC6A2 P23975 2/20 0.46
▸ SLC6A4 P31645 2/20 0.46
▸ SLC6A3 Q01959 2/20 0.46
▸ CA1 P00915 3/20 0.44
▸ CA2 P00918 3/20 0.44
▸ CA9 Q16790 3/20 0.44
▸ ALDH1A1 P00352 5/20 0.42
▸ KMT2A Q03164 6/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ MAPT P10636 4/20 0.40
▸ GAA P10253 3/20 0.40
▸ MITF O75030 1/20 0.40
▸ NCOA1 Q15788 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ NCOA3 Q9Y6Q9 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.39
▸ P2RX7 Q99572 1/20 0.39
▸ HPGD P15428 2/20 0.38

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
SCHEMBL11554587 0.81 SIRT1 (0.53) CTSDSLC6A2SLC6A4SLC6A3ALDH1A1
SCHEMBL31163274 0.79 POLB (0.59) CA1CA2CA9ALDH1A1KMT2A
SCHEMBL2461047 0.79 POLB (0.59) CA1CA2CA9ALDH1A1KMT2A
SCHEMBL6939026 0.75 KMT2A (0.63) ALDH1A1KMT2AMEN1MAPTGAA
SCHEMBL962966 0.74 CTSD (1.00) CTSDALDH1A1KMT2AMEN1MAPT
SCHEMBL1336721 0.73 LMNA (0.42) ALDH1A1KMT2AMEN1MAPTGAA
SCHEMBL239328 0.73 CTSD (0.63) CTSDCA1CA2CA9ALDH1A1
SCHEMBL30547074 0.73 CTSD (0.63) CTSDCA1CA2CA9ALDH1A1
SCHEMBL6942406 0.72 HPGD (0.57) CTSDALDH1A1KMT2AMAPTTDP1
Hydroxyamine SCHEMBL14300671 0.71 CTSD (0.61) CTSDCA1CA2CA9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4810282-A 3-ORTHO-(ISOXAZOLYL,ISOTHIAZOLYL, PYRAZOLYL,THIADIAZOLYL, OXADIAZOLYL AND TRIAZOLYL BENZENESULFONUREYLENE-1,2,4-TRIAZOLES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-03-07 — — US disclosed
EP-0083975-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-11-19 — — EP disclosed
US-4695311-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-09-22 — — US disclosed
US-4606755-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-08-19 — — US disclosed
US-4511392-A N--/PYRIMIDIN-2-YLAMINOCARBENYL/-HETERO-SUBSTITUETED BENZENSESULFO E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-04-16 — — US disclosed
EP-0083975-A2 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1983-07-20 — — EP disclosed
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