SCHEMBL13344403

SCHEMBL13344403

COC(=O)c1ccc2nc(C(=O)NCc3ccc4c(c3)NC(=O)CO4)[nH]c(=O)c2c1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 12/20 0.59
MMP8 P22894 6/20 0.59
TSHR P16473 1/20 0.52
MAOA P21397 1/20 0.48
KDM4E B2RXH2 1/20 0.45
MAPT P10636 1/20 0.45
PARP1 P09874 2/20 0.45

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
SCHEMBL13344189 0.93 MMP13 (0.59) MMP13MMP8TSHRMAOAKDM4E
SCHEMBL8189556 0.91 MMP13 (0.62) MMP13MMP8TSHRMAOAMAPT
SCHEMBL13344440 0.90 MMP13 (0.59) MMP13MMP8TSHRMAOAMAPT
SCHEMBL8189550 0.90 MMP13 (0.61) MMP13MMP8TSHRMAOAKDM4E
SCHEMBL13344218 0.90 MMP13 (0.62) MMP13MMP8TSHRMAOAPARP1
SCHEMBL8198673 0.89 MMP13 (0.62) MMP13MMP8TSHRMAOAMAPT
SCHEMBL13344220 0.89 MMP13 (0.60) MMP13MMP8TSHR
SCHEMBL13369329 0.88 MMP13 (0.59) MMP13MMP8TSHRMAOAMAPT
SCHEMBL8187445 0.88 MMP13 (0.62) MMP13MMP8TSHRMAOAMAPT
SCHEMBL8197438 0.88 MMP13 (0.62) MMP13MMP8TSHRMAOAPARP1

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-7713966-B2 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2010-05-11 US disclosed
US-7713966-B2 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2010-05-11 US disclosed
US-20080261968-A1 Heterobicyclic metalloprotease inhibitors GEGE CHRISTIAN 2008-10-23 US disclosed
US-20080261968-A1 Heterobicyclic metalloprotease inhibitors GEGE CHRISTIAN 2008-10-23 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-20080261968-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 MMP13 1/4885MMP8 5/4885TSHR 4335/4885

“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.