SCHEMBL6318449

SCHEMBL6318449

Cc1cc(COc2ccc(C3(N4CCN(CCO)CC4)C(=O)NC(=O)NC3=O)cc2)c2ccccc2n1

nearest known ligand 0.83

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 16/20 0.83
MMP2 P08253 5/20 0.83
MMP13 P45452 4/20 0.83
MMP9 P14780 4/20 0.83
MMP12 P39900 1/20 0.57

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
SCHEMBL6319255 0.91 ADAM17 (1.00) ADAM17MMP2MMP13MMP9MMP12
SCHEMBL6319361 0.90 ADAM17 (1.00) ADAM17MMP2MMP13MMP9
SCHEMBL6319679 0.90 ADAM17 (0.81) ADAM17MMP2MMP13MMP9MMP12
SCHEMBL6319765 0.89 ADAM17 (1.00) ADAM17MMP2MMP13MMP9MMP12
SCHEMBL6322043 0.89 ADAM17 (1.00) ADAM17MMP2MMP13MMP9MMP12
SCHEMBL6318592 0.89 ADAM17 (1.00) ADAM17MMP2MMP13MMP9MMP12
SCHEMBL6325076 0.88 ADAM17 (1.00) ADAM17MMP2MMP13MMP9MMP12
SCHEMBL6322594 0.88 ADAM17 (1.00) ADAM17MMP2MMP13MMP9
SCHEMBL6328387 0.88 ADAM17 (0.77) ADAM17MMP2MMP13MMP9MMP12
SCHEMBL6319318 0.87 ADAM17 (0.83) ADAM17MMP2MMP13MMP9MMP12

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-6936620-B2 Barbituric acid derivatives as inhibitors of TNF-α converting enzyme (TACE) and/or matrix metalloproteinases BRISTOL MYERS SQUIBB COMPANY (US) 2005-08-30 US claimed
US-20050064383-A1 Methods and apparatus for producing gender enriched sperm BASHKIN JAMES K (US) 2005-03-24 US claimed

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-20050064383-A1 Methods and apparatus for producing gender enriched sperm NASP, ALPG, ACR ADAM17 3172/4885MMP2 2897/4885MMP13 3119/4885

“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.