SCHEMBL6435225

SCHEMBL6435225

COC(=O)C1(S(=O)(=O)N2CCC(c3ccc(Br)c(C)c3)CC2)CC=CC1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 11/20 0.38
MMP2 P08253 9/20 0.38
MMP9 P14780 4/20 0.37
MMP1 P03956 2/20 0.37
MMP14 P50281 2/20 0.37
MAPT P10636 2/20 0.36
KMT2A Q03164 1/20 0.36
CHRNA3 P32297 1/20 0.34
ADAM10 O14672 2/20 0.34
QDPR P09417 1/20 0.34
TP53 P04637 1/20 0.34
USP5 P45974 2/20 0.33

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
SCHEMBL6437561 0.88 MMP3 (0.38) MMP3MMP2MMP9MMP1MMP14
SCHEMBL6438533 0.88 MMP3 (0.38) MMP3MMP2MMP9MMP1MMP14
SCHEMBL6434289 0.87 CYP3A4 (0.44) MMP3MMP2MMP9MMP1MAPT
SCHEMBL6436433 0.84 MMP3 (0.35) MMP3MMP2MMP9MMP1MMP14
SCHEMBL6437442 0.84 MMP3 (0.35) MMP3MMP2MMP9MMP1MMP14
SCHEMBL7204028 0.82 MAPT (0.38) MMP3MMP2MMP9MMP1MMP14
SCHEMBL6435679 0.81 CYP3A4 (0.46) MMP3MMP2MMP9MMP1MMP14
SCHEMBL6966717 0.80 MAPT (0.36) MMP3MMP2MMP9MMP1MMP14
SCHEMBL6966714 0.80 MAPT (0.36) MMP3MMP2MMP9MMP1MMP14
SCHEMBL6966720 0.80 MAPT (0.36) MMP3MMP2MMP9MMP1MMP14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050026836-A1 Composition for the treatment of damaged tissue DACK KEVIN NEIL (GB) 2005-02-03 US disclosed
US-20030199440-A1 Composition for the treatment of damaged tissue PFIZER INC. 2003-10-23 US disclosed
EP-1181017-B1 METALLOPROTEASE INHIBITORS PFIZER LTD (GB) 2003-04-16 EP disclosed
US-6511993-B1 Substituted alpha-aminosulphonyl-acetohydroxamic acids which are inhibitors of zinc-dependent metalloprotease enzymes PFIZER INC. 2003-01-28 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 (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-20030199440-A1 Composition for the treatment of damaged tissue MMP1, SERPINE1, COL14A1 MMP3 28/4885MMP2 19/4885MMP9 44/4885
US-20050026836-A1 Composition for the treatment of damaged tissue MMP1, SERPINE1, COL14A1 MMP3 28/4885MMP2 19/4885MMP9 44/4885

“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.