SCHEMBL5510023

SCHEMBL5510023

COCc1ccc(S(N)(=O)=O)s1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA2 P00918 15/20 0.49
CA1 P00915 5/20 0.43
CA12 O43570 4/20 0.43
CA9 Q16790 4/20 0.43
LOX P28300 4/20 0.43
DPP4 P27487 1/20 0.40
CA4 P22748 1/20 0.40
CA7 P43166 1/20 0.40
LOXL2 Q9Y4K0 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
SCHEMBL4648549 0.79 CA2 (0.47) CA2CA1CA12CA9LOX
SCHEMBL10167828 0.76 LOX (0.59) CA2LOXLOXL2
SCHEMBL4645445 0.76 CA2 (0.44) CA2CA1CA12CA9LOX
SCHEMBL9686299 0.75 DPP4 (0.53) CA2DPP4
SCHEMBL2010210 0.75 CA2 (0.56) CA2CA1CA12CA9LOX
SCHEMBL38666703 0.75 CA2 (0.47) CA2CA1CA12CA9LOX
SCHEMBL25034033 0.74 CA2 (0.52) CA2CA1CA12CA9LOX
SCHEMBL3096712 0.74 CA2 (0.47) CA2CA1CA12CA9LOX
SCHEMBL9537737 0.74 CA2 (0.58) CA2CA1CA12CA9LOX
SCHEMBL13160602 0.74 CA2 (0.43) CA2CA1CA12CA9LOX

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7250430-B2 Thiophene-and thiazolesulfonamides as antineoplastic agents ELI LILLY AND COMPANY (US) 2007-07-31 US disclosed
US-7250430-B2 Thiophene-and thiazolesulfonamides as antineoplastic agents ELI LILLY AND COMPANY (US) 2007-07-31 US disclosed
US-7250430-B2 Thiophene-and thiazolesulfonamides as antineoplastic agents ELI LILLY AND COMPANY (US) 2007-07-31 US disclosed
CN-1298709-C Thiophene-amd thiazolesulfonamides as antineoplastic agents LILLY CO ELI (US) 2007-02-07 CN disclosed
US-20060223871-A1 Thiophene-and thiazolesulfonamides as antineoplastic agents GROSSMAN CORA S 2006-10-05 US disclosed
EP-1442030-B1 THIOPENE- AMD THIAZOLESULFONAMIDES AS ANTINEOPLASTIC AGENTS LILLY CO ELI (US) 2006-08-30 EP disclosed
US-7084170-B2 Thiophene-amd thiazolesulfonamides as antineoplastic agents ELI LILLY AND COMPANY (US) 2006-08-01 US disclosed
CN-1575286-A Thiophene-amd thiazolesulfonamides as antineoplastic agents LILLY CO ELI (US) 2005-02-02 CN disclosed
US-20040198784-A1 Thiophene-amd thiazolesulfonamides as antineoplastic agents GROSSMAN CORA SUE (US) 2004-10-07 US disclosed
EP-1442030-A1 THIOPENE- AMD THIAZOLESULFONAMIDES AS ANTINEOPLASTIC AGENTS ELI LILLY AND COMPANY (US) 2004-08-04 EP disclosed
WO-2003035629-A1 THIOPENE- AMD THIAZOLESULFONAMIDES AS ANTINEOPLASTIC AGENTS ELI LILLY AND COMPANY (US) 2003-05-01 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060223871-A1 Thiophene-and thiazolesulfonamides as antineoplastic agents TPMT, TST, MGMT CA2 1394/4885CA1 1002/4885CA12 290/4885
US-20040198784-A1 Thiophene-amd thiazolesulfonamides as antineoplastic agents ALDH1A2, MGMT, NR2E3 CA2 2965/4885CA1 4169/4885CA12 2289/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.