SCHEMBL3659654

SCHEMBL3659654

CC[C@H](CC(=O)O)c1ccc(F)c(OC)c1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.56
FFAR1 O14842 4/20 0.51
POLB P06746 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.42
TNF P01375 1/20 0.42
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41

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
SCHEMBL3655663 1.00 GAA (0.56) GAAFFAR1POLBPTGDR2TNF
SCHEMBL8337209 0.94 GAA (0.58) GAAFFAR1POLBTNF
SCHEMBL2499134 0.90 GAA (0.52) GAAFFAR1POLB
SCHEMBL2497911 0.90 GAA (0.52) GAAFFAR1POLB
SCHEMBL2499131 0.87 PDE4A (0.47) GAATNFPDE4APDE4BPDE4C
SCHEMBL2497909 0.87 PDE4A (0.47) GAATNFPDE4APDE4BPDE4C
SCHEMBL20091067 0.84 CYP3A4 (0.39) GAA
SCHEMBL3657093 0.84 GAA (0.57) GAAFFAR1POLBTNFPDE4A
SCHEMBL1682681 0.84 GAA (0.77) GAAFFAR1PDE4D
SCHEMBL3658199 0.84 GAA (0.57) GAAFFAR1POLBTNFPDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8030354-B2 2-(5,5-Dimethylcyclopent-1-enyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; metabolic disorders such as type II diabetes AMGEN INC. (US) 2011-10-04 US disclosed
EP-2205548-A1 SUBSTITUTED BIPHENYL GPR40 MODULATORS Amgen, Inc (US) 2010-07-14 EP disclosed
US-20090137561-A1 Substituted biphenyl GPR40 modulators AMGEN INC. (US) 2009-05-28 US disclosed
US-20090137561-A1 Substituted biphenyl GPR40 modulators AMGEN INC. (US) 2009-05-28 US disclosed
WO-2009048527-A1 SUBSTITUTED BIPHENYL GPR40 MODULATORS AMGEN INC. (US) 2009-04-16 WO 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-20090137561-A1 Substituted biphenyl GPR40 modulators GPR119, GPR65, GPR55 GAA 1114/4885FFAR1 18/4885POLB 4464/4885

“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.