SCHEMBL7124781

SCHEMBL7124781

CC(C)C[C@H](C(=O)NO)N(CCN1C(=O)CNC1=O)S(=O)(=O)Cc1ccc2sccc2c1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.43
MMP13 P45452 3/20 0.43
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
MMP1 P03956 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
BRD4 O60885 3/20 0.32
ATAD2 Q6PL18 3/20 0.32
CECR2 Q9BXF3 3/20 0.32
HTR1D P28221 1/20 0.31
OPRM1 P35372 1/20 0.30
OPRK1 P41145 1/20 0.30

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
SCHEMBL7124787 1.00 MMP2 (0.43) MMP2MMP13CA1CA2MMP1
SCHEMBL7114246 0.85 MMP2 (0.33) MMP2MMP13HTR1D
SCHEMBL7114256 0.84 MMP2 (0.41) MMP2MMP13CA1CA2MMP1
SCHEMBL7128682 0.84 MMP2 (0.40) MMP2MMP13BRD4ATAD2CECR2
SCHEMBL7114248 0.84 MMP2 (0.41) MMP2MMP13CA1CA2MMP1
SCHEMBL7128688 0.84 MMP2 (0.40) MMP2MMP13BRD4ATAD2CECR2
SCHEMBL7116464 0.84 MMP2 (0.34) MMP2MMP13
SCHEMBL7123678 0.77 MMP2 (0.44) MMP2MMP13CA1CA2MMP1
SCHEMBL7123675 0.77 MMP2 (0.44) MMP2MMP13CA1CA2MMP1
SCHEMBL7123531 0.75 MMP2 (0.42) MMP2MMP13CA1CA2MMP1

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-20030134880-A1 Novel cd23 inhibitors SMITHKLINE BEECHAM P.L.C. (GB) 2003-07-17 US claimed
US-20030134880-A1 Novel cd23 inhibitors SMITHKLINE BEECHAM P.L.C. (GB) 2003-07-17 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-20030134880-A1 Novel cd23 inhibitors CD2, CD22, CD40 MMP2 1392/4885MMP13 335/4885CA1 1864/4885

“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.