SCHEMBL10731823

SCHEMBL10731823

Cc1ccc(S(=O)(=O)C(=CNc2ccc(Br)cn2)S(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.59
▸ ALDH1A1 P00352 10/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ HTT P42858 1/20 0.47
▸ PKM P14618 1/20 0.46
▸ LMNA P02545 2/20 0.46
▸ KDM4E B2RXH2 2/20 0.45
▸ NPC1 O15118 2/20 0.44
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ ATM Q13315 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ RAB9A P51151 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ BRD4 O60885 1/20 0.39
▸ NOD2 Q9HC29 1/20 0.39
▸ POLB P06746 1/20 0.37
▸ TSHR P16473 1/20 0.37

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
SCHEMBL10727222 0.95 MAPT (0.50) MAPTALDH1A1SMN1; SMN2HTTPKM
SCHEMBL10717754 0.93 ALDH1A1 (0.52) MAPTALDH1A1SMN1; SMN2PKMLMNA
SCHEMBL10732444 0.90 MAPT (0.49) MAPTALDH1A1SMN1; SMN2HTTPKM
SCHEMBL10730945 0.88 PKM (0.58) MAPTALDH1A1SMN1; SMN2PKMLMNA
SCHEMBL10732657 0.87 PKM (0.47) MAPTALDH1A1SMN1; SMN2HTTPKM
SCHEMBL10732434 0.87 NPC1 (0.47) MAPTALDH1A1PKMLMNANPC1
SCHEMBL10716660 0.86 ALDH1A1 (0.49) MAPTALDH1A1SMN1; SMN2HTTPKM
SCHEMBL10718971 0.83 CA2 (0.53) MAPTALDH1A1SMN1; SMN2HTTPKM
SCHEMBL10726208 0.83 PKM (0.52) MAPTALDH1A1SMN1; SMN2HTTPKM
SCHEMBL10732117 0.83 PKM (0.52) MAPTALDH1A1SMN1; SMN2PKMLMNA

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 1 patent. 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
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