SCHEMBL6380323

SCHEMBL6380323

CC1(C)OCCN(S(=O)(=O)c2ccc(OCCc3ccncc3)cc2)[C@H]1C(=O)NO

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 19/20 0.60
ADAM17 P78536 8/20 0.60
MMP13 P45452 9/20 0.53
MMP3 P08254 8/20 0.53
MMP7 P09237 6/20 0.53
MMP2 P08253 5/20 0.53
MMP9 P14780 2/20 0.53
MMP8 P22894 1/20 0.53
MMP14 P50281 1/20 0.53

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
SCHEMBL6382111 0.91 MMP1 (0.72) MMP1ADAM17MMP13MMP3MMP7
SCHEMBL6425793 0.90 MMP1 (0.61) MMP1ADAM17MMP13MMP3MMP7
SCHEMBL7075595 0.84 MMP1 (0.75) MMP1ADAM17MMP13MMP3MMP7
SCHEMBL5759087 0.84 MMP1 (0.84) MMP1ADAM17
SCHEMBL6382211 0.82 MMP1 (0.72) MMP1ADAM17MMP13MMP3MMP8
SCHEMBL6386785 0.80 MMP1 (0.53) MMP1ADAM17MMP13MMP3MMP2
SCHEMBL6383350 0.78 MMP1 (0.52) MMP1ADAM17MMP13MMP3MMP2
SCHEMBL6380302 0.78 MMP1 (0.50) MMP1ADAM17MMP13
SCHEMBL5759603 0.76 MMP1 (0.54) MMP1ADAM17MMP13MMP3MMP7
SCHEMBL7507399 0.76 MMP1 (0.54) MMP1ADAM17MMP13MMP3MMP7

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 MMP1 18/4885ADAM17 22/4885MMP13 35/4885
US-20050215549-A1 TACE inhibitors ADAMTS5, ADAMTS1, MMP2 MMP1 15/4885ADAM17 19/4885MMP13 34/4885

“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.