SCHEMBL2000083

SCHEMBL2000083

CCC(Oc1ccc(Br)cc1C(=O)c1cnn(-c2ccccc2)c1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 16/20 0.67
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
MEN1 O00255 1/20 0.48
GAA P10253 1/20 0.48
KMT2A Q03164 1/20 0.48
MAPT P10636 2/20 0.47
HPGD P15428 2/20 0.47
HTT P42858 2/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47

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
SCHEMBL5552117 0.91 PTGDR2 (0.71) PTGDR2RAB9ANPC1MEN1GAA
SCHEMBL1996701 0.88 PTGDR2 (0.55) PTGDR2RAB9ANPC1MAPT
SCHEMBL1994973 0.87 PTGDR2 (0.68) PTGDR2RAB9ANPC1MEN1GAA
SCHEMBL1994972 0.87 PTGDR2 (0.68) PTGDR2RAB9ANPC1MEN1GAA
SCHEMBL5553189 0.83 PTGDR2 (0.59) PTGDR2KMT2AMAPTHPGDHTT
SCHEMBL1994430 0.81 PTGDR2 (1.00) PTGDR2RAB9ANPC1MAPT
SCHEMBL1993750 0.80 PTGDR2 (1.00) PTGDR2RAB9ANPC1MAPTHTT
SCHEMBL1995200 0.78 PTGDR2 (0.76) PTGDR2RAB9ANPC1MAPTHPGD
SCHEMBL1994664 0.77 PTGDR2 (0.53) PTGDR2RAB9ANPC1MAPTHPGD
SCHEMBL2000166 0.77 PTGDR2 (0.59) PTGDR2RAB9ANPC1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269763-A1 CRTH2 receptor ligands for medicinal uses 7TM PHARMA A/S (DK) 2011-11-03 US disclosed
US-8022063-B2 CRTH2 receptor ligands for medicinal uses 7TM PHARMA A/S (DK) 2011-09-20 US disclosed
EP-2336113-A1 CRTH2 Receptor Ligands for Medical Use 7TM Pharma A/S (DK) 2011-06-22 EP 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-20110269763-A1 CRTH2 receptor ligands for medicinal uses HRH1, HRH2, HRH4 PTGDR2 61/4885RAB9A 2089/4885NPC1 2431/4885

“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.