SCHEMBL7072474

SCHEMBL7072474

Cc1ccc(S(=O)(=O)N2CC(NC(=O)OC(C)(C)C)C[C@H]2C(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 14/20 0.51
MMP9 P14780 5/20 0.51
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 1/20 0.48
MMP3 P08254 4/20 0.48
MMP1 P03956 3/20 0.48
MMP13 P45452 3/20 0.48
MMP7 P09237 2/20 0.48
CAPN1 P07384 1/20 0.47
POLB P06746 1/20 0.46
ANPEP P15144 1/20 0.45
ALDH1A1 P00352 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL7072473 1.00 MMP2 (0.51) MMP2MMP9CA12CA1CA2
SCHEMBL13254806 0.83 MMP2 (0.54) MMP2MMP9CA12CA1CA2
SCHEMBL13282810 0.83 MMP2 (0.54) MMP2MMP9CA12CA1CA2
SCHEMBL10904756 0.80 ALDH1A1 (0.61) MMP2MMP9CA12CA1CA2
SCHEMBL10904755 0.80 ALDH1A1 (0.61) MMP2MMP9CA12CA1CA2
SCHEMBL5503977 0.76 MMP2 (0.66) MMP2MMP9CA12CA1CA2
SCHEMBL29508846 0.76 LMNA (0.66) ALDH1A1KMT2A
SCHEMBL23630457 0.75 POLB (0.61) MMP2POLBANPEPALDH1A1KMT2A
SCHEMBL3832846 0.75 POLB (0.61) MMP2POLBANPEPALDH1A1KMT2A
SCHEMBL6097783 0.75 POLB (0.61) MMP2POLBANPEPALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6586602-B2 CD antigen antagonists such as N-(methanesulfonyl)-L-prolyl-L-phenylalanine and prodrugs used as antiinflammatory agents BIOGEN IDEC INTERNATIONAL HOLDING LTD. (BM) 2003-07-01 US disclosed
US-20030065193-A1 Benzyl compounds which inhibit leukocyte adhesion mediated by VLA-4 BIOGEN IDEC INTERNATIONAL HOLDING LTD. (BM) 2003-04-03 US disclosed
US-6362341-B1 ANTIINFLAMMATORY AGENTS ATHENA NEUROSCIENCES, INC. 2002-03-26 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-20030065193-A1 Benzyl compounds which inhibit leukocyte adhesion mediated by VLA-4 VCAM1, ICAM1, ITGB4 MMP2 472/4885MMP9 498/4885CA12 2883/4885

“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.