SCHEMBL6791350

SCHEMBL6791350

O=C(N[C@@H]1CCOC[C@@H]1C(=O)NO)c1ccc(Cc2c(C(F)(F)F)nc3ccccn23)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 8/20 1.00
ADAM17 P78536 10/20 0.63
MMP7 P09237 3/20 0.59
ADAMTS4 O75173 1/20 0.59
ADAMTS5 Q9UNA0 1/20 0.59
MMP3 P08254 3/20 0.56
MMP10 P09238 1/20 0.55

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
SCHEMBL6790245 0.92 MMP12 (0.85) MMP12ADAM17MMP7MMP3MMP10
SCHEMBL6796161 0.89 MMP12 (0.81) MMP12ADAM17MMP7ADAMTS4ADAMTS5
SCHEMBL6786496 0.88 MMP12 (1.00) MMP12ADAM17MMP7MMP3MMP10
SCHEMBL6785159 0.87 MMP12 (1.00) MMP12ADAM17MMP7MMP3MMP10
SCHEMBL6784996 0.86 MMP12 (0.95) MMP12ADAM17MMP7MMP3MMP10
SCHEMBL6791941 0.86 MMP12 (0.75) MMP12ADAM17MMP7ADAMTS4ADAMTS5
SCHEMBL6791375 0.86 MMP12 (1.00) MMP12ADAM17MMP7MMP3MMP10
SCHEMBL6785006 0.85 MMP12 (0.77) MMP12ADAM17MMP7MMP3MMP10
SCHEMBL6788932 0.82 MMP12 (0.70) MMP12ADAM17MMP7ADAMTS4ADAMTS5
SCHEMBL6796844 0.81 MMP12 (0.68) MMP12ADAM17MMP7MMP3

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-6740649-B2 ANTIINFLAMMATORY AGENTS; OSTEOPOROSIS BRISTOL-MYERS SQUIBB COMPANY 2004-05-25 US claimed
US-20030139388-A1 Cyclic hydroxamic acids as inhibitors of matrix metalloproteinases and/or TNF-alpha converting enzyme (TACE) BRISTOL-MYERS SQUIBB COMPANY (FORMERLY D/B/A DUPONT PHARMACEUTICALS COMPANY) 2003-07-24 US claimed
US-6740649-B2 ANTIINFLAMMATORY AGENTS; OSTEOPOROSIS BRISTOL-MYERS SQUIBB COMPANY 2004-05-25 US disclosed
US-20030139388-A1 Cyclic hydroxamic acids as inhibitors of matrix metalloproteinases and/or TNF-alpha converting enzyme (TACE) BRISTOL-MYERS SQUIBB COMPANY (FORMERLY D/B/A DUPONT PHARMACEUTICALS COMPANY) 2003-07-24 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-20030139388-A1 Cyclic hydroxamic acids as inhibitors of matrix metalloproteinases and/or TNF-alpha converting enzyme (TACE) ADAMTS1, MMP1, ADAM17 MMP12 24/4885ADAM17 3/4885MMP7 25/4885

“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.