SCHEMBL4901282

SCHEMBL4901282

CCOP(=O)(OCC)C(F)(F)c1ccc(Cn2c(-c3ccc(S(C)(=O)=O)cc3)cn(C)c2=O)cc1Br

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 6/20 0.36
PTPN1 P18031 3/20 0.34
NR1H2 P55055 1/20 0.33
BRD4 O60885 1/20 0.32
GCGR P47871 2/20 0.32
PTPN2 P17706 1/20 0.32
MAPK8 P45983 1/20 0.31
MAPK9 P45984 1/20 0.31
MAPK10 P53779 1/20 0.31
PTGS1 P23219 1/20 0.31
KIF11 P52732 1/20 0.31

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
SCHEMBL4899986 0.89 PTPN1 (0.34) PTGS2PTPN1PTPN2MAPK8MAPK9
SCHEMBL4903141 0.88 NR1H2 (0.34) PTGS2PTPN1NR1H2
SCHEMBL4899373 0.88 PTPN1 (0.44) PTGS2PTPN1NR1H2GCGRPTPN2
SCHEMBL4900094 0.85 SDHB (0.34) PTGS2PTPN1NR1H2
SCHEMBL4897222 0.85 NOTUM (0.38) MAPK8MAPK10
SCHEMBL4901292 0.84 PTPN1 (0.33) PTGS2PTPN1NR1H2GCGRPTPN2
SCHEMBL4901615 0.83 KMT2A (0.38) PTGS2NR1H2
SCHEMBL14257193 0.83 GCGR (0.34) PTGS2PTPN1NR1H2GCGRPTPN2
SCHEMBL4901609 0.82 MKNK1 (0.37) PTGS2MAPK8MAPK9MAPK10
SCHEMBL4894169 0.81 NR1H2 (0.36) PTGS2PTPN1NR1H2PTPN2MAPK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080070867-A1 2-Imidazolone and 2-Imidazolidinone Heterocyclic Inhibitors of Tyrosine Phosphatases METABASIS THERAPEUTICS, INC. (US) 2008-03-20 US disclosed
WO-2006078698-A1 2-IMIDAZOLONE AND 2-IMIDAZOLIDINONE HETEROCYCLIC INHIBITORS OF TYROSINE PHOSPHATASES CENGENT THERAPEUTICS, INC. (US) 2006-07-27 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-20080070867-A1 2-Imidazolone and 2-Imidazolidinone Heterocyclic Inhibitors of Tyrosine Phosphatases PPM1B, PPM1D, PTPRS PTGS2 1384/4885PTPN1 13/4885NR1H2 2792/4885

“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.