SCHEMBL6448310

SCHEMBL6448310

CC(=O)Nc1ccc(S(=O)(=O)NC(=O)C(O)=CC(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.56
▸ CA2 P00918 2/20 0.56
▸ MMP1 P03956 1/20 0.56
▸ MMP2 P08253 1/20 0.56
▸ MMP9 P14780 1/20 0.56
▸ MMP8 P22894 1/20 0.56
▸ MMP13 P45452 1/20 0.56
▸ POLB P06746 3/20 0.54
▸ IDO1 P14902 4/20 0.52
▸ MEN1 O00255 3/20 0.51
▸ KMT2A Q03164 3/20 0.51
▸ GAA P10253 1/20 0.51
▸ GFER P55789 1/20 0.51
▸ CA12 O43570 1/20 0.50
▸ CA9 Q16790 1/20 0.50
▸ ALDH1A1 P00352 4/20 0.49
▸ F2 P00734 1/20 0.49
▸ PRSS1 P07477 1/20 0.49
▸ PRSS2 P07478 1/20 0.49
▸ PRSS3 P35030 1/20 0.49

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
SCHEMBL6448306 1.00 CA1 (0.56) CA1CA2MMP1MMP2MMP9
SCHEMBL6450083 0.82 LMNA (0.51) CA1CA2MMP1MMP2MMP9
SCHEMBL6450080 0.82 LMNA (0.51) CA1CA2MMP1MMP2MMP9
SCHEMBL10992157 0.80 CA1 (0.73) CA1CA2MMP1MMP2MMP9
SCHEMBL11590063 0.75 CA1 (0.67) CA1CA2MMP1MMP2MMP9
SCHEMBL9967797 0.74 CA1 (0.64) CA1CA2MMP1MMP2MMP9
SCHEMBL11227377 0.74 IDO1 (0.67) CA1CA2MMP1MMP2MMP9
Glyoxylate SCHEMBL11418946 0.74 CA1 (0.59) CA1CA2MMP1MMP2MMP9
SCHEMBL8224012 0.73 CA1 (1.00) CA1CA2MMP1MMP2MMP9
SCHEMBL28550935 0.73 CA1 (0.73) CA1CA2MMP1MMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6890942-B2 Acyl sulfonamides as inhibitors of HIV integrase BRISTOL-MYERS SQUIBB COMPANY (US) 2005-05-10 — — US claimed
US-20050004232-A1 Acyl sulfonamides as inhibitors of HIV integrase BRISTOL-MYERS SQUIBB COMPANY 2005-01-06 — — US claimed
WO-2004103278-A2 ACYL SULFONAMIDES AS INHIBITORS OF HIV INTEGRASE BRISTOL-MYERS SQUIBB COMPANY (US) 2004-12-02 — — WO claimed
US-6890942-B2 Acyl sulfonamides as inhibitors of HIV integrase BRISTOL-MYERS SQUIBB COMPANY (US) 2005-05-10 — — US disclosed
US-20050004232-A1 Acyl sulfonamides as inhibitors of HIV integrase BRISTOL-MYERS SQUIBB COMPANY 2005-01-06 — — US 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 (1 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-20050004232-A1 Acyl sulfonamides as inhibitors of HIV integrase ACSS2, ARSA, ASS1 CA1 4121/4885CA2 3717/4885MMP1 3545/4885

“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.

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