SCHEMBL6380693

SCHEMBL6380693

CC1(C)OCCN(SS(=O)(=O)c2ccc(OCc3nc4cc(C(F)(F)F)ccc4s3)cc2)[C@@H]1C(=O)NO

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.38
MMP1 P03956 19/20 0.38
ADAM17 P78536 9/20 0.38
MMP13 P45452 1/20 0.36

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
SCHEMBL6384644 0.89 MMP1 (0.46) MMP1ADAM17
SCHEMBL27527617 0.82 ALOX5AP (0.40) ALOX5APMMP1ADAM17
SCHEMBL6380696 0.80 MMP1 (0.59) MMP1ADAM17MMP13
SCHEMBL5757157 0.80 MMP1 (0.61) MMP1ADAM17
SCHEMBL6386163 0.76 MMP1 (0.53) MMP1ADAM17MMP13
SCHEMBL5760182 0.74 ADAM17 (0.48) MMP1ADAM17MMP13
SCHEMBL8521422 0.73 AKR1B1 (0.40) ALOX5APMMP1ADAM17MMP13
SCHEMBL5760409 0.73 MMP1 (0.48) MMP1ADAM17
SCHEMBL27505029 0.72 MMP1 (0.47) MMP1ADAM17MMP13
SCHEMBL27538251 0.72 NPSR1 (0.41) ALOX5AP

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-20050215549-A1 TACE inhibitors MCCLURE KIM F 2005-09-29 US disclosed
US-20030181441-A1 TACE INHIBITORS McCLURE Kim (US) 2003-09-25 US disclosed
EP-0960098-A1 ARYLSULFONYL HYDROXAMIC ACID DERIVATIVES PFIZER INC. (US) 1999-12-01 EP disclosed
WO-1998034918-A1 ARYLSULFONYL HYDROXAMIC ACID DERIVATIVES PFIZER INC. (US) 1998-08-13 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-20030181441-A1 TACE INHIBITORS ADAMTS5, ADAMTS1, MMP2 ALOX5AP 4415/4885MMP1 18/4885ADAM17 22/4885
US-20050215549-A1 TACE inhibitors ADAMTS5, ADAMTS1, MMP2 ALOX5AP 4534/4885MMP1 15/4885ADAM17 19/4885

“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.