SCHEMBL17700667

SCHEMBL17700667

CCOC(=O)CC(COC)c1cccc(O)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.46
F2 P00734 4/20 0.46
PRSS1 P07477 1/20 0.46
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.38
HIF1A Q16665 1/20 0.38
GALR3 O60755 1/20 0.38
TSHR P16473 1/20 0.37
CA12 O43570 3/20 0.36
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA7 P43166 3/20 0.36
CA9 Q16790 3/20 0.36
CA14 Q9ULX7 3/20 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
SCHEMBL5661841 0.87 F10 (0.48) F10F2PRSS1ALDH1A1LMNA
SCHEMBL12193281 0.87 F2 (0.45) F10F2PRSS1ALDH1A1LMNA
SCHEMBL2499245 0.87 F2 (0.45) F10F2PRSS1ALDH1A1LMNA
SCHEMBL2506034 0.87 F2 (0.45) F10F2PRSS1ALDH1A1LMNA
SCHEMBL13882334 0.84 F10 (0.46) F10F2PRSS1LMNAHIF1A
SCHEMBL2504231 0.83 GAA (0.44) F10LMNAHIF1AGALR3TSHR
SCHEMBL17700759 0.81 F10 (0.40) F10F2PRSS1ALDH1A1LMNA
SCHEMBL12192903 0.81 OPRD1 (0.45) F10F2PRSS1ALDH1A1LMNA
SCHEMBL12192906 0.81 OPRD1 (0.45) F10F2PRSS1ALDH1A1LMNA
SCHEMBL12192897 0.81 F10 (0.48) F10F2PRSS1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3031799-B1 AROMATIC COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2018-04-04 EP disclosed
US-9776962-B2 Aromatic compounds with GPR40 agonistic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-10-03 US disclosed
EP-3031799-A1 AROMATIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2016-06-15 EP disclosed
US-20160115128-A1 AROMATIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-04-28 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-20160115128-A1 AROMATIC COMPOUND GLP1R, GPR119, GPR39 F10 2043/4885F2 4367/4885PRSS1 1799/4885

“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.