SCHEMBL2769293

SCHEMBL2769293

CS(=O)(=O)c1ccc(SSc2ccc(S(C)(=O)=O)cc2Cl)c(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
G6PD P11413 1/20 0.56
IDE P14735 1/20 0.56
LMNA P02545 1/20 0.49
PTGS2 P35354 4/20 0.42
ALDH1A1 P00352 3/20 0.41
MAPT P10636 1/20 0.41
CA2 P00918 1/20 0.41
CYP2C19 P33261 2/20 0.40
PDK1 Q15118 1/20 0.40
PDK2 Q15119 1/20 0.40
PDK3 Q15120 1/20 0.40
PDK4 Q16654 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MEN1 O00255 1/20 0.40
PPARG P37231 1/20 0.40
KMT2A Q03164 1/20 0.40
NCOA2 Q15596 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
SCHEMBL755309 0.79 LMNA (0.60) LMNAPTGS2ALDH1A1MAPTMEN1
SCHEMBL3575971 0.76 G6PD (0.56) G6PDIDEPTGS2ALDH1A1CA2
SCHEMBL863161 0.75 PTGS2 (0.58) LMNAPTGS2ALDH1A1MAPTCA2
SCHEMBL9988774 0.73 LMNA (0.50) G6PDIDELMNAPTGS2ALDH1A1
SCHEMBL303829 0.73 CA1 (0.68) G6PDIDELMNAPTGS2ALDH1A1
SCHEMBL12833714 0.73 LMNA (0.50) G6PDIDELMNAPTGS2ALDH1A1
SCHEMBL3752334 0.73 LMNA (0.50) G6PDIDELMNAPTGS2ALDH1A1
SCHEMBL585689 0.73 PTGS2 (0.65) LMNAPTGS2MEN1KMT2APTGS1
SCHEMBL709850 0.73 LMNA (0.50) G6PDIDELMNAPTGS2ALDH1A1
SCHEMBL30526834 0.73 LMNA (0.50) G6PDIDELMNAPTGS2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1910357-B1 INDOLI ZINE DERIVATIVES AND THEIR USE AS CRTH2 ANTAGONISTS ARGENTA DISCOVERY LTD (GB) 2010-04-14 EP disclosed
US-20100010034-A1 CRTH2 ANTAGONISTS ARGENTA DISCOVERY LIMITED (GB) 2010-01-14 US disclosed
EP-2094266-A1 CRTH2 ANTAGONISTS Argenta Discovery Limited (GB) 2009-09-02 EP disclosed
US-20090163534-A1 Indolizine Derivatives ARGENTA DISCOVERY LIMITED (GB) 2009-06-25 US disclosed
US-20080306109-A1 Indolizine Derivatives as Ligands of the Crth2 Receptor ARGENTA DISCOVERY LIMITED (GB) 2008-12-11 US disclosed
WO-2008074966-A1 CRTH2 ANTAGONISTS ARGENTA DISCOVERY LIMITED (GB) 2008-06-26 WO disclosed
EP-1931663-A1 IMDOLIZINE DERIVATIVES AS LIGANDS OF THE CRTH2 RECEPTOR Argenta Discovery Limited (GB) 2008-06-18 EP disclosed
EP-1910357-A2 INDOLI ZINE DERIVATIVES AND THEIR USE AS CRTH2 ANTAGONISTS Argenta Discovery Limited (GB) 2008-04-16 EP disclosed
WO-2007031747-A1 IMDOLIZINE DERIVATIVES AS LIGANDS OF THE CRTH2 RECEPTOR ARGENTA DISCOVERY LIMITED (GB) 2007-03-22 WO disclosed
WO-2006136859-A2 INDOLI ZINE DERIVATIVES AND THEIR USE AS CRTH2 ANTAGONISTS ARGENTA DISCOVERY LIMITED (GB) 2006-12-28 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 (3 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-20080306109-A1 Indolizine Derivatives as Ligands of the Crth2 Receptor HRH4, HRH2, HRH3 G6PD 3461/4885IDE 3527/4885LMNA 4224/4885
US-20090163534-A1 Indolizine Derivatives HRH4, HRH2, NR1H2 G6PD 2189/4885IDE 3326/4885LMNA 3422/4885
US-20100010034-A1 CRTH2 ANTAGONISTS HRH2, MDH2, HRH1 G6PD 1287/4885IDE 4634/4885LMNA 2207/4885

“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.