SCHEMBL9866733

SCHEMBL9866733

CNS(=O)(=O)Oc1cccc(S(=O)(=O)NC(C)(C)C)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
NSD2 O96028 2/20 0.36
KIF18A Q8NI77 10/20 0.34
ALDH1A1 P00352 2/20 0.33
PARG Q86W56 1/20 0.33
CENPE Q02224 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
ADRB2 P07550 1/20 0.32
ADRB1 P08588 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL9866318 0.77 ALDH1A1 (0.36) SMN1; SMN2LMNAALDH1A1
SCHEMBL8112810 0.73 SLC40A1 (0.49) MAPTSMN1; SMN2KDM4EMEN1NPC1
SCHEMBL2996719 0.72 MAPT (0.45) MAPTSMN1; SMN2KDM4EMEN1NPC1
SCHEMBL9378913 0.72 KIF18A (0.47) MAPTSMN1; SMN2KDM4EMEN1NPC1
SCHEMBL8322949 0.72 MAPT (0.45) MAPTSMN1; SMN2KDM4EMEN1NPC1
SCHEMBL22120881 0.72 NSD2 (0.49) MAPTSMN1; SMN2KDM4EMEN1NPC1
SCHEMBL9865417 0.70 SMN1; SMN2 (0.37) SMN1; SMN2KDM4EALDH1A1
SCHEMBL9868471 0.70 CA12 (0.34) SMN1; SMN2LMNAALDH1A1CA12CA1
SCHEMBL9867057 0.68 ALDH1A1 (0.35) SMN1; SMN2KDM4EMEN1LMNAKMT2A
SCHEMBL9867680 0.67 NFE2L2 (0.34) ALDH1A1CA12CA1CA2CA9

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-4987141-A DERIVATIVES OF BENZENE OR PYRIDINE HAVING SULFONATE AND SULFENYL, SULFONIMIDE OR SULFONAMIDE GROUPS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-01-22 US disclosed
EP-0356029-A2 Insecticidal compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-02-28 EP disclosed