SCHEMBL6197213

SCHEMBL6197213

Oc1c(Cc2ccccc2)cnc2ccc(C#CCc3ccc4ocnc4c3)cc12

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 9/20 0.40
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
CTNNB1 P35222 1/20 0.34
WNT3A P56704 1/20 0.34
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL6194013 0.96 MMP13 (0.42) MMP13MEN1ALDH1A1GAAKMT2A
SCHEMBL6194134 0.87 MEN1 (0.40) MMP13MEN1ALDH1A1GAAKMT2A
SCHEMBL6211571 0.86 MMP13 (0.39) MMP13
SCHEMBL6196256 0.85 MMP13 (0.50) MMP13
SCHEMBL6842318 0.83 MMP13 (0.40) MMP13MEN1ALDH1A1GAAKMT2A
SCHEMBL6212629 0.82 MMP13 (0.41) MMP13
SCHEMBL6195366 0.82 MMP13 (0.46) MMP13
SCHEMBL6197248 0.82 MMP13 (0.47) MMP13MEN1KMT2A
SCHEMBL6193074 0.82 MMP13 (0.47) MMP13MEN1KMT2A
SCHEMBL6194329 0.82 MMP13 (0.55) MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539163-A1 4-HYDROXYQUINOLINE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS Warner-Lambert Company LLC (US) 2005-06-15 EP disclosed
US-20040043983-A1 Naphthalene derivatives as matrix metalloproteinase inhibitors LI JIE JACK (US) 2004-03-04 US disclosed
WO-2004014377-A1 4-HYDROXYQUINOLINE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 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 (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-20040043983-A1 Naphthalene derivatives as matrix metalloproteinase inhibitors MMP9, MMP8, MMP13 MMP13 3/4885MEN1 2172/4885ALDH1A1 1588/4885

“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.