SCHEMBL2991998

SCHEMBL2991998

CC(C)(C)OC(=O)Cc1ccc(Oc2ccc(C(=O)NCCc3c(Cl)cccc3Cl)cc2)c(C#N)c1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.48
PTGDR2 Q9Y5Y4 16/20 0.44
PTGDR Q13258 1/20 0.43
MAPK14 Q16539 2/20 0.43
CYP3A4 P08684 1/20 0.41
AR P10275 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
SCHEMBL2986695 0.89 PTGDR2 (0.54) PTGDR2PTGDR
SCHEMBL2985884 0.88 PTGDR2 (0.53) PTGDR2MAPK14
SCHEMBL2988202 0.88 PTGDR2 (0.50) TRPV1PTGDR2PTGDRMAPK14CYP3A4
SCHEMBL2984362 0.79 MAPK14 (0.40) MAPK14CYP3A4AR
SCHEMBL2990233 0.79 LPAR1 (0.49) PTGDR2MAPK14AR
SCHEMBL2986645 0.79 PLA2G7 (0.48) PTGDR2
SCHEMBL2986456 0.77 TRPV1 (0.54) TRPV1PTGDR2PTGDRMAPK14
SCHEMBL2986138 0.76 PTGDR2 (0.62) PTGDR2PTGDRMAPK14
SCHEMBL5132800 0.76 PTGDR2 (0.55) TRPV1PTGDR2PTGDRMAPK14
SCHEMBL2979609 0.76 PTGDR2 (0.61) PTGDR2PTGDRMAPK14

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
US-8492437-B2 4-substituted phenoxyphenylacetic acid derivatives ARRAY BIOPHARMA INC. (US) 2013-07-23 US disclosed
EP-2057115-B9 4-SUBSTITUTED PHENOXYPHENYLACETIC ACID DERIVATIVES ARRAY BIOPHARMA INC (US) 2012-12-26 EP disclosed
EP-2057115-B1 4-SUBSTITUTED PHENOXYPHENYLACETIC ACID DERIVATIVES ARRAY BIOPHARMA INC (US) 2012-10-03 EP disclosed
US-20120202854-A1 4-SUBSTITUTED PHENOXYPHENYLACETIC ACID DERIVATIVES ARRAY BIOPHARMA INC. (US) 2012-08-09 US disclosed
US-8183289-B2 4-substituted phenoxyphenylacetic acid derivatives ARRAY BIOPHARMA INC. (US) 2012-05-22 US disclosed
US-20100173955-A1 4-SUBSTITUTED PHENOXYPHENYLACETIC ACID DERIVATIVES ARRAY BIOPHARMA INC. (US) 2010-07-08 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 (2 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-20100173955-A1 4-SUBSTITUTED PHENOXYPHENYLACETIC ACID DERIVATIVES CD22, HRH2, CD74 TRPV1 1152/4885PTGDR2 12/4885PTGDR 18/4885
US-20120202854-A1 4-SUBSTITUTED PHENOXYPHENYLACETIC ACID DERIVATIVES CD22, HRH2, CD74 TRPV1 1152/4885PTGDR2 12/4885PTGDR 18/4885

“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.