SCHEMBL16155987

SCHEMBL16155987

O=C(O)Nc1ccc(S(=O)(=O)c2nn(NC(=O)Cc3ccc(Cl)cc3)c(=O)c3ccccc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRMT1 Q99873 1/20 0.46
▸ CA2 P00918 2/20 0.45
▸ CA12 O43570 1/20 0.45
▸ CA1 P00915 1/20 0.45
▸ CA9 Q16790 1/20 0.45
▸ AKR1B1 P15121 1/20 0.45
▸ ALDH1A1 P00352 3/20 0.43
▸ MEN1 O00255 6/20 0.43
▸ KMT2A Q03164 6/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ HPGD P15428 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ EGFR P00533 2/20 0.42
▸ ERBB2 P04626 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ CACNA1G O43497 1/20 0.41
▸ CACNA1H O95180 1/20 0.41
▸ CACNA1I Q9P0X4 1/20 0.41
▸ KDR P35968 1/20 0.41
▸ NPBWR1 P48145 1/20 0.40

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
SCHEMBL13721332 0.91 EGFR (0.50) CA2CA12CA1CA9AKR1B1
SCHEMBL13720284 0.89 EGFR (0.50) CA2CA12CA1CA9ALDH1A1
SCHEMBL13720542 0.87 KDM4E (0.45) PRMT1CA2CA12CA1CA9
SCHEMBL13720804 0.87 EGFR (0.50) CA2CA12CA1CA9ALDH1A1
SCHEMBL13720446 0.86 KDM4E (0.45) CA2CA12CA1CA9ALDH1A1
SCHEMBL13720857 0.86 KDM4E (0.43) CA2CA12CA1CA9ALDH1A1
SCHEMBL13858680 0.85 KDM4E (0.45) CA2CA12CA1CA9AKR1B1
SCHEMBL13720642 0.85 ABCB1 (0.48) CA2CA12CA1CA9ALDH1A1
SCHEMBL13720252 0.84 KDM4E (0.41) AKR1B1ALDH1A1MEN1KMT2AKDM4E
SCHEMBL13720767 0.82 MAPK8 (0.42) PRMT1CA2CA12CA1CA9

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-8859549-B2 Potassium channel modulators ABBVIE, INC. (US) 2014-10-14 — — US claimed
US-8859549-B2 Potassium channel modulators ABBVIE, INC. (US) 2014-10-14 — — US disclosed
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