SCHEMBL2299702

SCHEMBL2299702

O=C1NCCN1c1ccc(S(=O)(=O)O)c(-c2ccc(F)c(F)c2)c1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 13/20 0.38
FEN1 P39748 13/20 0.38
TDO2 P48775 2/20 0.38
PTGS2 P35354 2/20 0.37
PTGS1 P23219 1/20 0.34
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
HCRTR1 O43613 1/20 0.33

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
SCHEMBL2306298 0.89 TDO2 (0.39) ALOX5APFEN1TDO2HCRTR1
SCHEMBL2307068 0.89 TDO2 (0.40) ALOX5APFEN1TDO2
SCHEMBL2303196 0.88 PTGS2 (0.44) ALOX5APFEN1TDO2PTGS2PTGS1
SCHEMBL2299608 0.87 ALOX5 (0.39) ALOX5APFEN1TDO2HCRTR1
SCHEMBL2299338 0.86 HCRTR1 (0.39) ALOX5APFEN1TDO2PTGS2HCRTR1
SCHEMBL2297980 0.86 PKM (0.36) TDO2PTGS2
SCHEMBL2303530 0.84 PDK2 (0.34) TDO2
SCHEMBL2300754 0.84 ALDH1A1 (0.35) ALOX5APFEN1TDO2
SCHEMBL2302675 0.84 ALOX5 (0.42) PTGS2PTGS1
SCHEMBL14119484 0.84 HTR6 (0.39) TDO2

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-9034888-B2 Substituted 2-imidazolidones and analogs UNIVERSITE LAVAL (CA) 2015-05-19 US disclosed
EP-2536693-A1 SUBSTITUTED 2-IMIDAZOLIDONES AND ANALOGS Université Laval (CA) 2012-12-26 EP disclosed
US-20120309777-A1 SUBSTITUTED 2-IMIDAZOLIDONES AND ANALOGS UNIVERSITE LAVAL (CA) 2012-12-06 US disclosed
WO-2011100840-A1 SUBSTITUTED 2-IMIDAZOLIDONES AND ANALOGS UNIVERSITé LAVAL (CA) 2011-08-25 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-20120309777-A1 SUBSTITUTED 2-IMIDAZOLIDONES AND ANALOGS CCNY, RPS4Y1, TPX2 ALOX5AP 4772/4885FEN1 3053/4885TDO2 3925/4885

“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.