SCHEMBL11701964

SCHEMBL11701964

CNC(=O)C1=Cc2ccccc2S(=O)(=O)N1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC40A1 Q9NP59 1/20 0.40
CA12 O43570 3/20 0.39
CA2 P00918 3/20 0.39
CA9 Q16790 3/20 0.39
CA1 P00915 2/20 0.39
CA4 P22748 2/20 0.39
CA7 P43166 2/20 0.39
KDM4E B2RXH2 1/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.39
BCHE P06276 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
KMT2A Q03164 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
PTGES O14684 3/20 0.37
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL30218281 0.84 CA12 (0.39) CA12CA2CA9CA1CA4
SCHEMBL19138045 0.81 PTGES (0.55) CA12CA2CA9CA7LMNA
SCHEMBL7973834 0.81 SLC40A1 (0.40) SLC40A1CA12CA2CA9CA1
SCHEMBL6796058 0.80 CA12 (0.43) SLC40A1CA12CA2CA9CA1
SCHEMBL7190117 0.80 CA12 (0.43) CA12CA2CA9CA1CA4
Hydrochloric Acid SCHEMBL3809667 0.79 CA12 (0.42) SLC40A1CA12CA2CA9CA1
SCHEMBL9848829 0.79 CA12 (0.42) CA12CA2CA9CA1CA4
SCHEMBL11002885 0.79 CA12 (0.49) CA12CA2CA9CA1CA4
SCHEMBL30722860 0.76 NPC1 (0.49) KDM4EUSP2KMT2AALDH1A1GAA
SCHEMBL10812986 0.76 NPC1 (0.49) KDM4EUSP2KMT2AALDH1A1GAA

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-4011332-A RODENTICIDE BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DT) 1977-03-08 US disclosed