SCHEMBL6314287

SCHEMBL6314287

CC(C)(C)OC(=O)C(=O)Nc1sc2c(c1C(=O)OC(C)(C)C)CC(C(=O)N1Cc3ccccc3C1=O)OC2

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 11/20 0.41
PLA2G1B P04054 1/20 0.39
ATG4B Q9Y4P1 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.37
ALDH1A1 P00352 3/20 0.37
LMNA P02545 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
MAPT P10636 1/20 0.37
TSPO P30536 1/20 0.36
RAB7A P51149 2/20 0.35
HPGD P15428 2/20 0.34
KDM4E B2RXH2 1/20 0.34
HTT P42858 1/20 0.34
CXCR4 P61073 1/20 0.34
NT5E P21589 1/20 0.32
PTPN1 P18031 1/20 0.32

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
SCHEMBL6322122 0.94 RAB7A (0.42) CXCR2PLA2G1BATG4BSMN1; SMN2ALDH1A1
SCHEMBL5838257 0.91 CXCR2 (0.39) CXCR2PLA2G1BATG4BSMN1; SMN2ALDH1A1
SCHEMBL5836667 0.90 CXCR2 (0.36) CXCR2PLA2G1BATG4BSMN1; SMN2ALDH1A1
SCHEMBL5838623 0.88 CXCR2 (0.38) CXCR2PLA2G1BATG4BSMN1; SMN2ALDH1A1
SCHEMBL5838447 0.88 CXCR2 (0.39) CXCR2SMN1; SMN2ALDH1A1LMNANPSR1
SCHEMBL5838560 0.88 CXCR2 (0.37) CXCR2PLA2G1BATG4BSMN1; SMN2ALDH1A1
SCHEMBL6316317 0.88 CXCR2 (0.35) CXCR2PLA2G1BATG4BSMN1; SMN2ALDH1A1
SCHEMBL5838246 0.87 CXCR2 (0.39) CXCR2PLA2G1BATG4BSMN1; SMN2ALDH1A1
SCHEMBL6315579 0.87 CXCR2 (0.44) CXCR2PLA2G1BATG4BSMN1; SMN2ALDH1A1
SCHEMBL5837750 0.87 GABRA1 (0.35) CXCR2SMN1; SMN2ALDH1A1LMNANPSR1

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-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
EP-1080068-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES Novo Nordisk A/S (DK) 2001-03-07 EP disclosed
WO-1999046237-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES NOVO NORDISK A/S (DK) 1999-09-16 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-20030069267-A1 Modulators of protein tyrosine phosphatases (PTPases) PTPRCAP, PTPRS, PTPRA CXCR2 661/4885PLA2G1B 1707/4885ATG4B 4269/4885

“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.