SCHEMBL6607415

SCHEMBL6607415

CS(=O)(=O)NC(=O)c1ccc(-c2[c]cccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 6/20 0.51
P4HTM Q9NXG6 2/20 0.42
PTPN1 P18031 1/20 0.42
SCN5A Q14524 3/20 0.41
SCN3A Q9NY46 1/20 0.41
MAP4K4 O95819 1/20 0.41
MYC P01106 2/20 0.40
BCL2 P10415 1/20 0.40
BAK1 Q16611 1/20 0.40
SCN2B O60939 1/20 0.40
SCN1A P35498 1/20 0.40
SCN1B Q07699 1/20 0.40
CHEK1 O14757 1/20 0.39
PHGDH O43175 1/20 0.39
BCL2L1 Q07817 1/20 0.39
MCL1 Q07820 1/20 0.39

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
SCHEMBL6609151 0.83 HDAC2 (0.47) PTPN1
SCHEMBL31331542 0.80 SCN9A (0.64) SCN9AP4HTMPTPN1SCN3AMAP4K4
SCHEMBL6607417 0.78 SCN9A (0.60) SCN9AP4HTMPTPN1SCN5AMAP4K4
SCHEMBL6611172 0.77 MAPT (0.57)
SCHEMBL6608198 0.76 KEAP1 (0.53)
SCHEMBL6642630 0.76 TSHR (0.53) PTPN1
SCHEMBL364110 0.76 HDAC3 (0.58) SCN9AP4HTMPTPN1SCN5ASCN3A
SCHEMBL10469452 0.75 TSHR (0.48) BCL2L1
Hydrochloric Acid SCHEMBL4438185 0.75 P4HTM (0.56) SCN9AP4HTMPTPN1SCN5ASCN3A
SCHEMBL16618535 0.74 SCN9A (0.52) SCN9AP4HTMPTPN1SCN5AMAP4K4

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
EP-1423386-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-02 EP claimed
WO-2003022842-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-03-20 WO claimed