SCHEMBL8205552

SCHEMBL8205552

O=C1COc2ccc(CNC(=O)c3nc4cc5ccccc5cc4c(=O)[nH]3)cc2N1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 13/20 0.63
MMP8 P22894 8/20 0.63
TSHR P16473 1/20 0.52
PARP1 P09874 2/20 0.51
MAOA P21397 1/20 0.49
MMP2 P08253 2/20 0.46
MMP10 P09238 2/20 0.46
ALDH1A1 P00352 1/20 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
SCHEMBL13344138 0.92 MMP13 (0.66) MMP13MMP8TSHRPARP1MAOA
SCHEMBL8195905 0.89 MMP13 (0.62) MMP13MMP8TSHRPARP1MAOA
SCHEMBL8198440 0.89 MMP13 (0.63) MMP13MMP8TSHRPARP1MAOA
SCHEMBL13344411 0.89 MMP13 (0.61) MMP13MMP8TSHRPARP1MAOA
SCHEMBL8198673 0.88 MMP13 (0.62) MMP13MMP8TSHRPARP1MAOA
SCHEMBL8202049 0.88 MMP13 (0.64) MMP13MMP8TSHRPARP1MAOA
SCHEMBL8187462 0.87 MMP13 (0.63) MMP13MMP8TSHRPARP1MAOA
SCHEMBL13344212 0.87 MMP13 (0.61) MMP13MMP8TSHRPARP1MAOA
SCHEMBL13344177 0.86 MMP8 (0.62) MMP13MMP8TSHRPARP1MAOA
SCHEMBL8189556 0.86 MMP13 (0.62) MMP13MMP8TSHRPARP1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100249102-A1 Heterotricyclic Metalloprotease Inhibitors ALANTOS PHARMACEUTICALS HOLDINGS, INC. (US) 2010-09-30 US disclosed
US-20100249102-A1 Heterotricyclic Metalloprotease Inhibitors ALANTOS PHARMACEUTICALS HOLDINGS, INC. (US) 2010-09-30 US disclosed
US-7749996-B2 Heterotricyclic metalloprotease inhibitors Alantos Pharmaceutical Holdings, Inc. (US) 2010-07-06 US disclosed
US-7749996-B2 Heterotricyclic metalloprotease inhibitors Alantos Pharmaceutical Holdings, Inc. (US) 2010-07-06 US disclosed
US-20100087420-A1 Heterotricyclic Metalloprotease Inhibitors ALANTOS PHARMACEUTICALS HOLDINGS, INC. (US) 2010-04-08 US disclosed
US-20100087420-A1 Heterotricyclic Metalloprotease Inhibitors ALANTOS PHARMACEUTICALS HOLDINGS, INC. (US) 2010-04-08 US disclosed
US-20080207607-A1 Heterotricyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. 2008-08-28 US disclosed
US-20080207607-A1 Heterotricyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. 2008-08-28 US disclosed
WO-2008063667-A1 HETEROTRICYCLIC METALLOPROTEASE INHIBITORS ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2008-05-29 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 (3 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-20100087420-A1 Heterotricyclic Metalloprotease Inhibitors MMP13, MMP3, TIMP3 MMP13 1/4885MMP8 5/4885TSHR 3519/4885
US-20100249102-A1 Heterotricyclic Metalloprotease Inhibitors MMP13, MMP3, TIMP3 MMP13 1/4885MMP8 5/4885TSHR 3519/4885
US-20080207607-A1 Heterotricyclic metalloprotease inhibitors MMP13, MMP3, TIMP3 MMP13 1/4885MMP8 5/4885TSHR 3519/4885

“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.