SCHEMBL4269569

SCHEMBL4269569

O=C(O)C(Cc1ccccc1)NS(=O)(=O)c1ccc(-c2ccc(-c3cccc4c3oc3ccccc34)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 15/20 0.66
MMP9 P14780 11/20 0.66
ADAMTS4 O75173 3/20 0.66
MMP13 P45452 2/20 0.61
MMP14 P50281 2/20 0.61
ADAMTS5 Q9UNA0 1/20 0.60
MMP1 P03956 1/20 0.60
MMP3 P08254 1/20 0.60
MMP7 P09237 1/20 0.60
ALDH1A1 P00352 1/20 0.52
MAPT P10636 1/20 0.52
MMP8 P22894 1/20 0.49
MMP12 P39900 1/20 0.49
POLB P06746 1/20 0.49

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
SCHEMBL5047244 0.86 MMP2 (0.53) MMP2MMP9ADAMTS4MMP13MMP14
SCHEMBL4262393 0.85 MMP13 (0.47) MMP2MMP9ADAMTS4MMP13MMP14
SCHEMBL5037885 0.84 MMP2 (0.52) MMP2MMP9ADAMTS4MMP13MMP14
SCHEMBL5037883 0.84 MMP2 (0.52) MMP2MMP9ADAMTS4MMP13MMP14
SCHEMBL5037617 0.84 MMP2 (0.53) MMP2MMP9ADAMTS4MMP13MMP14
SCHEMBL5037620 0.84 MMP2 (0.53) MMP2MMP9ADAMTS4MMP13MMP14
SCHEMBL6545297 0.81 MMP2 (1.00) MMP2MMP9ADAMTS4MMP13MMP14
SCHEMBL1920507 0.81 MMP2 (1.00) MMP2MMP9ADAMTS4MMP13MMP14
SCHEMBL32691761 0.81 MMP2 (1.00) MMP2MMP9ADAMTS4MMP13MMP14
SCHEMBL4271261 0.80 MMP2 (0.66) MMP2MMP9ADAMTS4MMP13MMP14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090082392-A1 Substituted Carboxylic Acids THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY LLC 2009-03-26 US claimed
JP-2006525329-A 2006-11-09 JP claimed
EP-1620420-A2 SUBSTITUTED CARBOXYLIC ACIDS The Institutes for Pharmaceutical Discovery, LLC (US) 2006-02-01 EP claimed
US-20040266788-A1 Substituted carboxylic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY LLC 2004-12-30 US claimed
WO-2004099168-A2 SUBSTITUTED CARBOXYLIC ACIDS THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY, LLC (US) 2004-11-18 WO 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 (2 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-20040266788-A1 Substituted carboxylic acids PTP4A1, PTPRS, G6PC1 MMP2 3873/4885MMP9 4496/4885ADAMTS4 4593/4885
US-20090082392-A1 Substituted Carboxylic Acids PTPRJ, PTPRS, PTPRG MMP2 3614/4885MMP9 4346/4885ADAMTS4 4500/4885

“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.