SCHEMBL5106708

SCHEMBL5106708

Cn1cc(/C=C/C(=O)O)c(OCc2ccccc2)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 7/20 0.53
PTGER2 P43116 7/20 0.53
PTGER3 P43115 7/20 0.53
PTGER1 P34995 4/20 0.53
MAP3K7 O43318 2/20 0.49
TAB1 Q15750 2/20 0.49
GAA P10253 1/20 0.49
PKM P14618 2/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 2/20 0.46
NPC1 O15118 1/20 0.46
NFKB1 P19838 1/20 0.46
RAB9A P51151 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
PTGDR Q13258 1/20 0.45
LTB4R Q15722 1/20 0.45

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
SCHEMBL5106711 1.00 PTGER4 (0.53) PTGER4PTGER2PTGER3PTGER1MAP3K7
SCHEMBL5407245 0.86 GAA (0.64) PTGER4PTGER2PTGER3PTGER1MAP3K7
SCHEMBL5407247 0.86 GAA (0.64) PTGER4PTGER2PTGER3PTGER1MAP3K7
SCHEMBL5411015 0.84 MEN1 (0.57) PTGER4PTGER2PTGER3PTGER1MAP3K7
SCHEMBL5411022 0.84 MEN1 (0.57) PTGER4PTGER2PTGER3PTGER1MAP3K7
SCHEMBL5121868 0.82 ADORA3 (0.44) PKMMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL30556899 0.81 ADORA3 (0.44) PKMMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL6593163 0.81 GAA (0.58) PTGER4PTGER2PTGER3PTGER1GAA
SCHEMBL6593156 0.81 GAA (0.58) PTGER4PTGER2PTGER3PTGER1GAA
SCHEMBL4703265 0.78 ALKBH1 (0.51) PTGER1PKMMEN1KMT2AALDH1A1

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
US-20080051418-A1 Arylalkanoic Acid Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-02-28 US disclosed
EP-1829863-A1 ARYLALKANOIC ACID DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2007-09-05 EP 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-20080051418-A1 Arylalkanoic Acid Derivative INSR, NPY1R, GPR119 PTGER4 1928/4885PTGER2 3643/4885PTGER3 1565/4885

“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.