SCHEMBL2989864

SCHEMBL2989864

CSC(=Cc1ccc(Oc2ccc(C(=O)NCCc3ccc(Cl)cc3)cc2)c(C(F)(F)F)c1)[S+](C)[O-]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 1/20 0.44
FABP2 P12104 1/20 0.44
PPARG P37231 1/20 0.44
PPARD Q03181 1/20 0.44
GAA P10253 2/20 0.44
PTGDR2 Q9Y5Y4 10/20 0.42
CCR2 P41597 3/20 0.41
CCR1 P32246 1/20 0.41
CCR5 P51681 1/20 0.41
TRPV1 Q8NER1 2/20 0.40
NPC1 O15118 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAPT P10636 1/20 0.40
CYP2C19 P33261 1/20 0.40
RAB9A P51151 1/20 0.40
GFER P55789 1/20 0.40
CA1 P00915 1/20 0.39

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
SCHEMBL2989862 1.00 PPARA (0.44) PPARASMN1; SMN2ALDH1A1FABP2PPARG
SCHEMBL2989859 1.00 PPARA (0.44) PPARASMN1; SMN2ALDH1A1FABP2PPARG
SCHEMBL2982871 0.88 GAA (0.46) PPARASMN1; SMN2ALDH1A1FABP2PPARG
SCHEMBL2982873 0.88 GAA (0.46) PPARASMN1; SMN2ALDH1A1FABP2PPARG
SCHEMBL2982870 0.88 GAA (0.46) PPARASMN1; SMN2ALDH1A1FABP2PPARG
SCHEMBL2990070 0.85 PTGDR2 (0.54) GAAPTGDR2
SCHEMBL2990068 0.85 PTGDR2 (0.54) GAAPTGDR2
SCHEMBL2990074 0.85 PTGDR2 (0.54) GAAPTGDR2
SCHEMBL2990191 0.83 SMN1; SMN2 (0.50) PPARASMN1; SMN2ALDH1A1FABP2PPARG
SCHEMBL2986649 0.77 PPARA (0.53) PPARASMN1; SMN2ALDH1A1FABP2PPARG

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 PPARA 874/4885SMN1; SMN2 3361/4885ALDH1A1 610/4885
US-20120202854-A1 4-SUBSTITUTED PHENOXYPHENYLACETIC ACID DERIVATIVES CD22, HRH2, CD74 PPARA 874/4885SMN1; SMN2 3361/4885ALDH1A1 610/4885

“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.