SCHEMBL5567907

SCHEMBL5567907

Cc1ccccc1C(=O)c1cnc(NCCCCNC(=O)OC(C)(C)C)s1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 5/20 0.42
STK17B O94768 1/20 0.42
STK17A Q9UEE5 1/20 0.42
CYP3A4 P08684 1/20 0.42
FPR3 P25089 2/20 0.41
FPR2 P25090 2/20 0.41
MAPK14 Q16539 1/20 0.40
P2RY2 P41231 1/20 0.40

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
SCHEMBL5567831 0.98 STK17B (0.44) BRD4STK17BSTK17ACYP3A4FPR3
SCHEMBL5569227 0.94 BCHE (0.43) BRD4CYP3A4MAPK14
SCHEMBL5568771 0.87 STK17B (0.44) BRD4STK17BSTK17ACYP3A4FPR3
SCHEMBL5564081 0.87 MAPK13 (0.52) STK17BSTK17AMAPK14
SCHEMBL5568708 0.86 STK17B (0.43) BRD4STK17BSTK17ACYP3A4FPR3
SCHEMBL14421789 0.85 CA12 (0.43) MAPK14P2RY2
SCHEMBL5568050 0.83 METAP2 (0.40) MAPK14
SCHEMBL5569746 0.83 MAPK14 (0.43) CYP3A4MAPK14
SCHEMBL5568720 0.82 MAPK14 (0.44) CYP3A4MAPK14
SCHEMBL5564128 0.81 LCK (0.48) BRD4

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
EP-1480976-B1 THIAZOLE DERIVATIVES AS NPY RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2007-09-19 EP disclosed
EP-1480976-B1 THIAZOLE DERIVATIVES AS NPY RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2007-09-19 EP disclosed
EP-1480976-A1 THIAZOLE DERIVATIVES AS NPY RECEPTOR ANTAGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2004-12-01 EP disclosed
US-6686381-B2 COMPOUNDS THAT ANTAGONIZE NEUROPEPTIDE Y AT THE Y5 RECEPTOR SUBTYPE REPRESENT AN APPROACH TO THE TREATMENT OF EATING DISORDERS SUCH AS OBESITY AND HYPERPHAGIA HOFFMANN-LA ROCHE INC. 2004-02-03 US disclosed
US-20030225141-A1 THIAZOLE DERIVATIVES HOFFMANN-LA ROCHE INC. 2003-12-04 US disclosed
WO-2003072577-A1 THIAZOLE DERIVATIVES AS NPY RECEPTOR ANTAGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2003-09-04 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-20030225141-A1 THIAZOLE DERIVATIVES SLC5A1, GPR119, TAS1R1 BRD4 1714/4885STK17B 2852/4885STK17A 2657/4885

“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.