SCHEMBL13630285

SCHEMBL13630285

CC[C@H](CC(=O)OC)c1ccc(OC2CCc3cc(-c4ccc5c(c4)OCO5)ccc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 13/20 0.43
PPARG P37231 2/20 0.41
PPARA Q07869 2/20 0.41
KMT2A Q03164 2/20 0.39
RAB9A P51151 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
MEN1 O00255 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
SCHEMBL13630286 0.91 FFAR1 (0.49) FFAR1PPARGPPARAKMT2A
SCHEMBL13630354 0.91 FFAR1 (0.49) FFAR1PPARGPPARAKMT2A
SCHEMBL13616747 0.86 FFAR1 (0.58) FFAR1
SCHEMBL13630180 0.85 FFAR1 (0.51) FFAR1
SCHEMBL13681336 0.83 FFAR1 (0.45) FFAR1
SCHEMBL13681352 0.82 FFAR1 (0.44) FFAR1
SCHEMBL13630178 0.82 FFAR1 (0.47) FFAR1
SCHEMBL13630679 0.81 FFAR1 (0.47) FFAR1
SCHEMBL13630290 0.80 FFAR1 (0.47) FFAR1
SCHEMBL13630731 0.79 FFAR1 (0.49) FFAR1

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-20090275598-A1 Conformationally constrained 3-(4-hydroxy-phenyl)-substituted-propanoic acids useful for treating metabolic disorders AMGEN INC. (US) 2009-11-05 US disclosed
US-7582803-B2 Conformationally constrained 3-(4-hydroxy-phenyl)-substituted-propanoic acids useful for treating metabolic disorders AMGEN INC. (US) 2009-09-01 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-20090275598-A1 Conformationally constrained 3-(4-hydroxy-phenyl)-substituted-propanoic acids useful for treating metabolic disorders PC, PNLIP, PDHX FFAR1 51/4885PPARG 26/4885PPARA 7/4885

“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.