SCHEMBL2769434

SCHEMBL2769434

Cc1c(CC(=O)O)c2ccccn2c1S(=O)(=O)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 14/20 0.41
ABCB1 P08183 2/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
PTGDR Q13258 3/20 0.37
CYP2C9 P11712 1/20 0.37
CNR1 P21554 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
ACLY P53396 1/20 0.36

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
SCHEMBL2770132 0.90 ABCB1 (0.44) PTGDR2ABCB1PTGS1PTGS2PTGDR
SCHEMBL2770449 0.88 ACLY (0.44) PTGS2CNR1KDM4EACLY
SCHEMBL2770435 0.83 ALDH1A1 (0.40) PTGDR2PTGDRCYP2C9
SCHEMBL13800545 0.79 HCRTR2 (0.46) PTGDR2ABCB1PTGS1PTGS2CYP2C9
SCHEMBL2774077 0.72 POLB (0.38) PTGDR2PTGS2PTGDRCNR1KDM4E
SCHEMBL4635639 0.71 HCRTR1 (0.47) PTGDR2ABCB1PTGS1PTGS2PTGDR
SCHEMBL2771980 0.71 GAA (0.51) KDM4E
SCHEMBL13800532 0.70 ABCB1 (0.45) PTGDR2ABCB1PTGS1PTGS2
SCHEMBL2584567 0.69 HCRTR1 (0.52) PTGDR2PTGDRCYP2C9KDM4EHCRTR1
SCHEMBL2770023 0.68 HCRTR1 (0.42) PTGS2KDM4EHCRTR1HCRTR2

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-1910357-B1 INDOLI ZINE DERIVATIVES AND THEIR USE AS CRTH2 ANTAGONISTS ARGENTA DISCOVERY LTD (GB) 2010-04-14 EP disclosed
US-20090163534-A1 Indolizine Derivatives ARGENTA DISCOVERY LIMITED (GB) 2009-06-25 US disclosed
US-20090163534-A1 Indolizine Derivatives ARGENTA DISCOVERY LIMITED (GB) 2009-06-25 US disclosed
US-20090163534-A1 Indolizine Derivatives ARGENTA DISCOVERY LIMITED (GB) 2009-06-25 US disclosed
EP-1910357-A2 INDOLI ZINE DERIVATIVES AND THEIR USE AS CRTH2 ANTAGONISTS Argenta Discovery Limited (GB) 2008-04-16 EP 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 (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-20090163534-A1 Indolizine Derivatives HRH4, HRH2, NR1H2 PTGDR2 363/4885ABCB1 1910/4885PTGS1 2131/4885

“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.