SCHEMBL2932935

SCHEMBL2932935

CCCCCN(CCCCC)C(=O)c1cc(C=C2SC(=S)N(CC(=O)O)C2=O)ccc1O

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPN22 Q9Y2R2 4/20 0.53
PTPN12 Q05209 1/20 0.53
FABP4 P15090 1/20 0.52
AKR1B1 P15121 9/20 0.52
MMP3 P08254 2/20 0.49
PTPN1 P18031 2/20 0.49
MMP13 P45452 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
KMT2A Q03164 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
SCHEMBL2933475 0.89 AKR1B1 (0.60) AKR1B1PTPN1KMT2A
SCHEMBL2925494 0.84 ADAMTS5 (0.69) AKR1B1PTPN1
SCHEMBL2928677 0.83 AKR1B1 (0.61) AKR1B1PTPN1
SCHEMBL6884607 0.82 PTPN22 (0.69) PTPN22PTPN12AKR1B1MMP3PTPN1
SCHEMBL6884614 0.82 PTPN22 (0.69) PTPN22PTPN12AKR1B1MMP3PTPN1
SCHEMBL2931055 0.81 ADAMTS5 (0.70) AKR1B1PTPN1
SCHEMBL2929627 0.81 MEN1 (0.51) AKR1B1PTPN1KMT2A
SCHEMBL6793007 0.80 PTPN12 (0.62) PTPN22PTPN12AKR1B1MMP3PTPN1
SCHEMBL6793003 0.80 PTPN12 (0.62) PTPN22PTPN12AKR1B1MMP3PTPN1
SCHEMBL20558691 0.79 PTPN12 (0.64) PTPN22PTPN12FABP4AKR1B1MMP3

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-6740670-B2 SUCH AS 5-(((3-(N-METHYL-N-PHENYLAMINO)CARBONYL-4-(PHENYL-METHOXY)) -PHENYL)METHYLENE)-4-OXO-2-THIOXO-3-THIAZOLIDINE-ACETIC ACID OXFORD GLYCOSCIENCES (UK) LTD. (GB) 2004-05-25 US claimed
EP-1313731-B1 THIAZOLIDINE DERIVATIVES AND ITS USE AS ANTIFUNGAL AGENT UCB SA (BE) 2010-09-29 EP disclosed
US-6740670-B2 SUCH AS 5-(((3-(N-METHYL-N-PHENYLAMINO)CARBONYL-4-(PHENYL-METHOXY)) -PHENYL)METHYLENE)-4-OXO-2-THIOXO-3-THIAZOLIDINE-ACETIC ACID OXFORD GLYCOSCIENCES (UK) LTD. (GB) 2004-05-25 US disclosed
US-20030216453-A1 Thiazolidine derivatives and its use as antifungal agent OXFORD GLYCOSCIENCES (UK) LTD (GB) 2003-11-20 US disclosed
EP-1313731-A1 THIAZOLIDINE DERIVATIVES AND ITS USE AS ANTIFUNGAL AGENT Oxford GlycoSciences (UK) Limited (GB) 2003-05-28 EP disclosed
WO-2002022612-A1 THIAZOLIDINE DERIVATIVES AND ITS USE AS ANTIFUNGAL AGENT OXFORD GLYCOSCIENCES (UK) LIMITED (GB) 2002-03-21 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-20030216453-A1 Thiazolidine derivatives and its use as antifungal agent CYP3A7, TAS2R7, OXSR1 PTPN22 803/4885PTPN12 817/4885FABP4 4581/4885

“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.