SCHEMBL1757451

SCHEMBL1757451

Cc1c(-c2nnc(O)c3ccccc23)c2cc(F)cc(Cl)c2n1CC(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 13/20 0.47
DGAT2 Q96PD7 1/20 0.36
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
PTGER2 P43116 1/20 0.32
PTGDR Q13258 1/20 0.32
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
JAK3 P52333 1/20 0.32
CCNT1 O60563 1/20 0.31

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
SCHEMBL1757695 0.92 PTGDR2 (0.45) PTGDR2DGAT2KDM4EALDH1A1JAK2
SCHEMBL1757983 0.91 PTGDR2 (0.45) PTGDR2DGAT2KDM4EALDH1A1JAK2
SCHEMBL1757753 0.85 PTGDR2 (0.51) PTGDR2ALDH1A1PTGDR
SCHEMBL1757714 0.83 PTGDR2 (0.52) PTGDR2
SCHEMBL1757993 0.81 PTGDR2 (0.46) PTGDR2KDM4EALDH1A1
SCHEMBL1757478 0.81 PTGDR2 (0.46) PTGDR2KDM4EALDH1A1
SCHEMBL1757736 0.74 PTGDR2 (0.59) PTGDR2
SCHEMBL1757156 0.74 PTGDR2 (0.45) PTGDR2KDM4EALDH1A1
SCHEMBL2206918 0.74 PTGDR2 (0.53) PTGDR2
SCHEMBL1758074 0.74 PTGDR2 (0.48) PTGDR2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011055270-A1 INDOLE BASED RECEPTOR CRTH2 ANTAGONISTS WYETH LLC (US) 2011-05-12 WO disclosed
US-20110105509-A1 INDOLE BASED RECEPTOR CRTH2 ANTAGONISTS WYETH, LLC (US) 2011-05-05 US 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-20110105509-A1 INDOLE BASED RECEPTOR CRTH2 ANTAGONISTS HRH2, CRHR2, CRHR1 PTGDR2 13/4885DGAT2 2950/4885KDM4E 4693/4885

“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.