SCHEMBL2990179

SCHEMBL2990179

CC(C)(C)OC(=O)Cc1ccc(Oc2ccc(C(=O)NCCc3ccc(Cl)cc3Cl)c(F)c2)c(C#N)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 5/20 0.43
TRPV1 Q8NER1 1/20 0.42
PTGDR Q13258 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PLA2G7 Q13093 2/20 0.39
EZH2 Q15910 1/20 0.38
DNMT3A Q9Y6K1 1/20 0.37
HTR2A P28223 2/20 0.37
SLC6A4 P31645 1/20 0.37
KCNH2 Q12809 1/20 0.37
PTGER4 P35408 1/20 0.36
SNCA P37840 1/20 0.36
CYP2C8 P10632 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
SLC22A6 Q4U2R8 1/20 0.36
SLC22A8 Q8TCC7 1/20 0.36
SLC22A12 Q96S37 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
SCHEMBL2986772 0.89 PTGDR2 (0.48) PTGDR2TRPV1PTGDRMEN1KMT2A
SCHEMBL2990185 0.81 EZH2 (0.38) PTGDR2PTGDRPLA2G7EZH2SLC22A12
SCHEMBL2986695 0.79 PTGDR2 (0.54) PTGDR2PTGDRCYP2C19
SCHEMBL2982720 0.77 PTGDR2 (0.60) PTGDR2TRPV1PTGDRSNCA
SCHEMBL2991998 0.76 TRPV1 (0.48) PTGDR2TRPV1PTGDR
SCHEMBL2985884 0.73 PTGDR2 (0.53) PTGDR2MEN1KMT2A
SCHEMBL2983522 0.73 PTGDR2 (0.53) PTGDR2TRPV1PTGDR
SCHEMBL2986645 0.70 PLA2G7 (0.48) PTGDR2MEN1KMT2APLA2G7
SCHEMBL2986773 0.70 PTGDR2 (0.40) PTGDR2PTGDRPLA2G7EZH2PTGER4
SCHEMBL2984362 0.69 MAPK14 (0.40) KMT2APLA2G7CYP2C9CYP2C19HPGD

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 PTGDR2 12/4885TRPV1 1152/4885PTGDR 18/4885
US-20120202854-A1 4-SUBSTITUTED PHENOXYPHENYLACETIC ACID DERIVATIVES CD22, HRH2, CD74 PTGDR2 12/4885TRPV1 1152/4885PTGDR 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.