SCHEMBL9209937

SCHEMBL9209937

O=S(=O)(Nc1cccnc1)c1ccc(I)cc1

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.72
▸ MEN1 O00255 1/20 0.72
▸ HTT P42858 4/20 0.67
▸ SMN1; SMN2 Q16637 4/20 0.67
▸ POLB P06746 3/20 0.67
▸ ALDH1A1 P00352 3/20 0.67
▸ LMNA P02545 3/20 0.62
▸ TSHR P16473 6/20 0.60
▸ CYP1A2 P05177 1/20 0.59
▸ CYP3A4 P08684 1/20 0.59
▸ CYP2D6 P10635 1/20 0.59
▸ CYP2C9 P11712 1/20 0.59
▸ CYP2C19 P33261 1/20 0.59
▸ GAA P10253 3/20 0.55
▸ KDM4E B2RXH2 1/20 0.54
▸ TP53 P04637 1/20 0.54
▸ TDP1 Q9NUW8 1/20 0.54

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
SCHEMBL1094118 0.85 MEN1 (0.73) KMT2AMEN1HTTSMN1; SMN2POLB
SCHEMBL31661903 0.85 MEN1 (0.73) KMT2AMEN1HTTSMN1; SMN2POLB
SCHEMBL9568492 0.84 KMT2A (0.72) KMT2AMEN1HTTSMN1; SMN2POLB
SCHEMBL10031630 0.84 KMT2A (0.72) KMT2AMEN1HTTSMN1; SMN2POLB
SCHEMBL28644956 0.84 KMT2A (1.00) KMT2AMEN1HTTSMN1; SMN2POLB
SCHEMBL8228775 0.84 POLB (0.91) KMT2AMEN1HTTSMN1; SMN2POLB
SCHEMBL2801932 0.81 KMT2A (0.68) KMT2AMEN1HTTSMN1; SMN2POLB
SCHEMBL2734370 0.80 CA2 (0.68) KMT2AMEN1HTTSMN1; SMN2POLB
SCHEMBL9207324 0.80 ALDH1A1 (0.69) KMT2AMEN1HTTSMN1; SMN2POLB
SCHEMBL1403148 0.79 KMT2A (0.74) KMT2AMEN1HTTSMN1; SMN2ALDH1A1

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-0532239-B1 Benzenesulphonamide derivatives as 5-lipoxygenase inhibitors ZENECA LTD (GB) 1995-12-13 — — EP disclosed
US-5403857-A Benzenesulphonamide derivatives having 5-lipoxygenase inhibitory activity IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1995-04-04 — — US disclosed
US-5314891-A Lipoxygenase inhibitors IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-05-24 — — US disclosed
EP-0532239-A1 Benzenesulphonamide derivatives as 5-lipoxygenase inhibitors ZENECA LIMITED (GB) 1993-03-17 — — EP disclosed
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