SCHEMBL10825800

SCHEMBL10825800

O=[N+]([O-])c1ccc(NS(=O)(=O)c2cccc3ccccc23)c(Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CRHBP P24387 1/20 0.65
▸ CRHR2 Q13324 1/20 0.65
▸ NHERF1 O14745 1/20 0.50
▸ RORC P51449 1/20 0.49
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ MAPT P10636 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ MCL1 Q07820 1/20 0.47
▸ CYP19A1 P11511 1/20 0.47
▸ NFKBIA P25963 1/20 0.46
▸ RELA Q04206 1/20 0.46
▸ GUSB P08236 1/20 0.46
▸ ACLY P53396 1/20 0.46
▸ DDX3X O00571 1/20 0.45
▸ DNMT1 P26358 1/20 0.44
▸ DNMT3A Q9Y6K1 1/20 0.44
▸ ATM Q13315 1/20 0.44

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
SCHEMBL10529379 0.81 CRHBP (0.82) CRHBPCRHR2MEN1KMT2AALDH1A1
SCHEMBL27410611 0.80 CRHBP (0.60) CRHBPCRHR2NHERF1RORCMEN1
SCHEMBL6571788 0.79 PKM (0.64) RORCMEN1KMT2AALDH1A1LMNA
SCHEMBL10529391 0.79 CRHBP (0.67) CRHBPCRHR2NHERF1MEN1KMT2A
SCHEMBL8309888 0.79 CRHBP (1.00) CRHBPCRHR2NHERF1MEN1KMT2A
SCHEMBL14707494 0.76 CRHBP (0.58) CRHBPCRHR2RORCMEN1KMT2A
SCHEMBL7572486 0.76 NFKBIA (0.56) CRHBPCRHR2NHERF1RORCMEN1
SCHEMBL2740998 0.74 CRHBP (0.60) CRHBPCRHR2NHERF1MEN1KMT2A
SCHEMBL10825507 0.74 MCL1 (0.60) CRHBPCRHR2NHERF1MEN1KMT2A
SCHEMBL7770318 0.74 TNNI3 (0.55) MEN1KMT2AALDH1A1LMNAMAPT

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
JP-61200958-A — — None — — JP disclosed
JP-S61200958-A NAPHTHALENESULFONAMIDE AND FUNGICIDE FOR AGRICULTURAL PURPOSES MITSUI TOATSU CHEM INC 1986-09-05 — — JP disclosed
Send feedback