SCHEMBL10730725

SCHEMBL10730725

Cc1ccnc(NC=C(S(=O)(=O)c2ccccc2)S(=O)(=O)c2ccccc2)c1[N+](=O)[O-]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.48
▸ ALDH1A1 P00352 4/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ PKM P14618 2/20 0.41
▸ HTT P42858 1/20 0.41
▸ MEN1 O00255 5/20 0.38
▸ KMT2A Q03164 5/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ RAB9A P51151 1/20 0.37
▸ EGFR P00533 1/20 0.36
▸ ERBB2 P04626 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36

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
SCHEMBL10730384 0.79 MAPT (0.56) MAPTALDH1A1KDM4EL3MBTL1NPC1
SCHEMBL10718982 0.73 MAPT (0.48) MAPTALDH1A1NPC1PKMLMNA
SCHEMBL10814167 0.72 MAPT (0.57) MAPTALDH1A1L3MBTL1NPC1PKM
SCHEMBL5439813 0.71 HPGD (0.44) MAPTALDH1A1KDM4ENPC1HTT
SCHEMBL5439819 0.71 HPGD (0.44) MAPTALDH1A1KDM4ENPC1HTT
SCHEMBL10725434 0.71 MAPT (0.49) MAPTALDH1A1KDM4EL3MBTL1NPC1
SCHEMBL10726355 0.70 MAPT (0.55) MAPTALDH1A1KDM4EL3MBTL1NPC1
SCHEMBL10730781 0.70 MAPT (0.58) MAPTALDH1A1KDM4ENPC1PKM
SCHEMBL10730985 0.70 MAPT (0.52) MAPTALDH1A1L3MBTL1NPC1PKM
SCHEMBL10716377 0.70 MAPT (0.56) MAPTALDH1A1KDM4ENPC1PKM

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-4647569-A Antiarthritic pyridylaminoethene disulfonyl compounds and use MAY & BAKER LIMITED (GB) 1987-03-03 — — US claimed
US-4647569-A Antiarthritic pyridylaminoethene disulfonyl compounds and use MAY & BAKER LIMITED (GB) 1987-03-03 — — US disclosed
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