SCHEMBL6315699

SCHEMBL6315699

O=C(O)CC1CCCc2sc(NC(=O)C(=O)O)c(C(=O)O)c21

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 16/20 0.54
PTPN2 P17706 6/20 0.54
PTPRC P08575 3/20 0.54
PTPRB P23467 2/20 0.54
PTPRE P23469 2/20 0.54
PTPN6 P29350 1/20 0.54
ABCC1 P33527 3/20 0.47
ABCG2 Q9UNQ0 1/20 0.47
PTPRA P18433 2/20 0.45
CXCR2 P25025 1/20 0.44

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
SCHEMBL5837972 0.71 PTPN1 (1.00) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL6314996 0.71 PTPN1 (0.35) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL21247652 0.68 KMT2A (0.53) ABCC1ABCG2CXCR2
SCHEMBL21603891 0.67 ABCC1 (0.64) ABCC1ABCG2CXCR2
SCHEMBL6415875 0.67 PTPN1 (0.50) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL6419481 0.67 PTPN1 (0.47) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL6314541 0.66 PTPN1 (1.00) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL15259283 0.66 PTPN1 (0.66) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL6414118 0.65 PTPN1 (0.48) PTPN1PTPN2PTPRCPTPRBPTPRE
SCHEMBL21260646 0.65 ABCC1 (0.62) ABCC1ABCG2CXCR2

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-6951878-B2 Benzo[b]thiophenyl or tetrahydro-benzo[b]thiophenyl modulators of protein tyrosine phosphatases (PTPases) NOVO NORDISK A/S (DK) 2005-10-04 US disclosed
US-20030069267-A1 Modulators of protein tyrosine phosphatases (PTPases) MOLLER NIELS PETER HUNDAHL (DK) 2003-04-10 US disclosed
US-6410586-B1 ANTICOAGULANTS; INSULIN RESISTANCE; ANTIALLERGENS NOVO NORDISK A/S (DK) 2002-06-25 US disclosed
US-6262044-B1 CONTAINING AN AMIDE-SUBSTITUTED TETRAHYDROTHIENOPYRIDINE RING NOVO NORDISK A/S (DK) 2001-07-17 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-20030069267-A1 Modulators of protein tyrosine phosphatases (PTPases) PTPRCAP, PTPRS, PTPRA PTPN1 7/4885PTPN2 9/4885PTPRC 6/4885

“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.