SCHEMBL2740992

SCHEMBL2740992

O=[N+]([O-])c1ccc(N/N=C/c2ccc(Oc3cccnc3)cc2)c(S(=O)(=O)Nc2ccccc2Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.49
▸ KMT2A Q03164 8/20 0.49
▸ HTT P42858 5/20 0.49
▸ SMN1; SMN2 Q16637 5/20 0.49
▸ NPC1 O15118 3/20 0.49
▸ RAB9A P51151 3/20 0.49
▸ PSMD14 O00487 2/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ ALPL P05186 1/20 0.48
▸ ALPI P09923 1/20 0.48
▸ ALPG P10696 1/20 0.48
▸ MAPT P10636 11/20 0.46
▸ GAA P10253 4/20 0.46
▸ ALDH1A1 P00352 4/20 0.46
▸ GLA P06280 2/20 0.46
▸ TLR9 Q9NR96 1/20 0.46
▸ CRHBP P24387 2/20 0.46
▸ CRHR2 Q13324 2/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ TNNI3 P19429 1/20 0.45

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
SCHEMBL2740985 0.88 MEN1 (0.54) MEN1KMT2AHTTSMN1; SMN2NPC1
SCHEMBL13128983 0.87 ALDH1A1 (0.43) MEN1KMT2AHTTSMN1; SMN2L3MBTL1
SCHEMBL2740986 0.86 MEN1 (0.56) MEN1KMT2AHTTSMN1; SMN2NPC1
SCHEMBL2741005 0.85 MEN1 (0.52) MEN1KMT2AHTTSMN1; SMN2NPC1
SCHEMBL2740948 0.82 L3MBTL1 (0.55) MEN1KMT2AHTTSMN1; SMN2NPC1
SCHEMBL2740990 0.82 L3MBTL1 (0.57) MEN1KMT2AHTTSMN1; SMN2NPC1
SCHEMBL2740949 0.81 MEN1 (0.54) MEN1KMT2AHTTSMN1; SMN2NPC1
SCHEMBL2741006 0.80 MEN1 (0.55) MEN1KMT2AHTTSMN1; SMN2NPC1
SCHEMBL2741007 0.79 MEN1 (0.58) MEN1KMT2AHTTSMN1; SMN2NPC1
SCHEMBL2740976 0.79 PSMD14 (0.53) MEN1KMT2AHTTSMN1; SMN2NPC1

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
US-8088772-B2 Sulfonamides and their use as a medicament THE GENETICS COMPANY, INC. (CH) 2012-01-03 — — US disclosed
US-8088772-B2 Sulfonamides and their use as a medicament THE GENETICS COMPANY, INC. (CH) 2012-01-03 — — US disclosed
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