SCHEMBL5214902

SCHEMBL5214902

O=C(O)CN1C(=O)C(=Cc2ccc(OCc3ccccc3)c(COc3ccccc3)c2)SC1=S

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.79
AKR1B1 P15121 3/20 0.79
MMP3 P08254 2/20 0.79
MMP13 P45452 2/20 0.79
GFER P55789 1/20 0.79
ADAMTS5 Q9UNA0 1/20 0.79

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
SCHEMBL5219645 1.00 PTPN1 (0.79) PTPN1AKR1B1MMP3MMP13GFER
SCHEMBL5223311 0.92 AKR1B1 (0.76) PTPN1AKR1B1MMP3MMP13GFER
SCHEMBL5214275 0.92 AKR1B1 (0.76) PTPN1AKR1B1MMP3MMP13GFER
SCHEMBL2932877 0.89 ADAMTS5 (0.79) PTPN1AKR1B1MMP3MMP13GFER
SCHEMBL2932876 0.89 ADAMTS5 (0.79) PTPN1AKR1B1MMP3MMP13GFER
SCHEMBL186520 0.89 ADAMTS5 (1.00) PTPN1AKR1B1ADAMTS5
SCHEMBL245003 0.89 ADAMTS5 (1.00) PTPN1AKR1B1ADAMTS5
SCHEMBL6887214 0.89 AKR1B1 (1.00) PTPN1AKR1B1MMP3MMP13GFER
SCHEMBL19736049 0.89 AKR1B1 (1.00) PTPN1AKR1B1MMP3MMP13GFER
SCHEMBL6887210 0.89 AKR1B1 (1.00) PTPN1AKR1B1MMP3MMP13GFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040006112-A1 Benzylidene thiazolidinediones and their use as antimycotic agents OXFORD GLYCOSCIENCES (UK) LTD (GB) 2004-01-08 US claimed
EP-1313471-B1 BENZYLIDENE THIAZOLIDINEDIONES AND THEIR USE AS ANTIMYCOTIC AGENTS UCB SA (BE) 2007-04-11 EP disclosed
US-7105554-B2 Benzylidene thiazolidinediones and their use as antimycotic agents OXFORD GLYCOSCIENCES (UK) LTD. (GB) 2006-09-12 US disclosed
US-20040006112-A1 Benzylidene thiazolidinediones and their use as antimycotic agents OXFORD GLYCOSCIENCES (UK) LTD (GB) 2004-01-08 US disclosed
EP-1313471-A1 BENZYLIDENE THIAZOLIDINEDIONES AND THEIR USE AS ANTIMYCOTIC AGENTS Oxford GlycoSciences (UK) Limited (GB) 2003-05-28 EP disclosed
WO-2002017915-A1 BENZYLIDENE THIAZOLIDINEDIONES AND THEIR USE AS ANTIMYCOTIC AGENTS OXFORD GLYCOSCIENCES (UK) LIMITED (GB) 2002-03-07 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-20040006112-A1 Benzylidene thiazolidinediones and their use as antimycotic agents SLC5A2, OXSR1, SLC5A1 PTPN1 1590/4885AKR1B1 594/4885MMP3 3555/4885

“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.