SCHEMBL2773676

SCHEMBL2773676

CN(Cc1ccc(OCC(=O)O)c(-c2cccc(S(C)(=O)=O)c2)c1)S(=O)(=O)c1ccc(F)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 15/20 0.53
NR1H2 P55055 2/20 0.44
NR1H3 Q13133 2/20 0.44
PTPN1 P18031 1/20 0.43
MAPT P10636 1/20 0.43
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42

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
SCHEMBL2772688 0.92 PTGDR2 (0.56) PTGDR2NR1H2NR1H3PTPN1MAPT
SCHEMBL12948708 0.91 PTGDR2 (0.44) PTGDR2PTPN1MAPTLMNATP53
SCHEMBL13160705 0.91 PTGDR2 (0.44) PTGDR2PTPN1MAPTLMNATP53
SCHEMBL2773060 0.89 PTGDR2 (0.54) PTGDR2PTPN1
SCHEMBL2771585 0.89 PTGDR2 (0.55) PTGDR2NR1H2NR1H3MAPTLMNA
SCHEMBL2773337 0.89 PTGDR2 (0.58) PTGDR2NR1H2NR1H3MAPTLMNA
SCHEMBL2771112 0.89 PTGDR2 (0.58) PTGDR2PTPN1MAPTLMNATP53
SCHEMBL2770575 0.88 PTGDR2 (0.47) PTGDR2PTPN1MAPTTP53
SCHEMBL2773046 0.87 PTGDR2 (0.64) PTGDR2PTPN1
SCHEMBL2772962 0.87 PTGDR2 (0.55) PTGDR2PTPN1MAPTLMNA

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
US-8822467-B2 Biaryl oxyacetic acid compounds LIGAND PHARMACEUTICALS INCORPORATED (US) 2014-09-02 US claimed
US-20130102609-A1 BIARYL OXYACETIC ACID COMPOUNDS LIGAND PHARMACEUTICALS INC. (US) 2013-04-25 US claimed
WO-2010102154-A2 BIARYL OXYACETIC ACID COMPOUNDS LIGAND PHARMACEUTICALS INCORPORATED (US) 2010-09-10 WO claimed
US-8822467-B2 Biaryl oxyacetic acid compounds LIGAND PHARMACEUTICALS INCORPORATED (US) 2014-09-02 US disclosed
US-8822467-B2 Biaryl oxyacetic acid compounds LIGAND PHARMACEUTICALS INCORPORATED (US) 2014-09-02 US disclosed
US-8822467-B2 Biaryl oxyacetic acid compounds LIGAND PHARMACEUTICALS INCORPORATED (US) 2014-09-02 US disclosed
US-20130102609-A1 BIARYL OXYACETIC ACID COMPOUNDS LIGAND PHARMACEUTICALS INC. (US) 2013-04-25 US disclosed
US-20130102609-A1 BIARYL OXYACETIC ACID COMPOUNDS LIGAND PHARMACEUTICALS INC. (US) 2013-04-25 US disclosed
US-20130102609-A1 BIARYL OXYACETIC ACID COMPOUNDS LIGAND PHARMACEUTICALS INC. (US) 2013-04-25 US disclosed
WO-2010102154-A2 BIARYL OXYACETIC ACID COMPOUNDS LIGAND PHARMACEUTICALS INCORPORATED (US) 2010-09-10 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-20130102609-A1 BIARYL OXYACETIC ACID COMPOUNDS HSD17B12, CYP2A13, CYP27A1 PTGDR2 377/4885NR1H2 74/4885NR1H3 44/4885

“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.