SCHEMBL3661382

SCHEMBL3661382

CC[C@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.59
SLC7A5 Q01650 1/20 0.56
PPARG P37231 7/20 0.55
EPHX2 P34913 3/20 0.52
ESR1 P03372 2/20 0.52
ESR2 Q92731 2/20 0.52
PPARA Q07869 3/20 0.51
PPARD Q03181 1/20 0.51
ACE P12821 3/20 0.49
MME P08473 1/20 0.49
CPA1 P15085 1/20 0.49
ACE2 Q9BYF1 1/20 0.49

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
SCHEMBL6379983 1.00 CYP1A2 (0.59) CYP1A2SLC7A5PPARGEPHX2ESR1
SCHEMBL3876493 1.00 CYP1A2 (0.59) CYP1A2SLC7A5PPARGEPHX2ESR1
SCHEMBL10436391 0.92 CYP1A2 (0.68) CYP1A2SLC7A5ESR1ESR2MME
SCHEMBL10436426 0.86 CYP1A2 (0.80) CYP1A2SLC7A5ACEMMECPA1
SCHEMBL5966674 0.85 ESR1 (0.54) CYP1A2SLC7A5PPARGEPHX2ESR1
SCHEMBL11529738 0.85 CYP1A2 (0.59) CYP1A2PPARGEPHX2PPARAPPARD
SCHEMBL265514 0.84 CYP1A2 (0.83) CYP1A2PPARGPPARAPPARDMME
SCHEMBL491524 0.84 CYP1A2 (0.83) CYP1A2PPARGPPARAPPARDMME
SCHEMBL265063 0.84 CYP1A2 (0.83) CYP1A2PPARGPPARAPPARDMME
SCHEMBL12494638 0.84 SLC7A5 (0.60) CYP1A2SLC7A5MMECPA1

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
EP-2139843-B1 SUBSTITUTED BIPHENYL PHENOXY-, THIOPHENYL- AND AMINOPHENYLPROPANOIC ACID GPR40 MODULATORS AMGEN INC (US) 2013-12-25 EP disclosed
EP-2139843-A1 SUBSTITUTED BIPHENYL PHENOXY-, THIOPHENYL- AND AMINOPHENYLPROPANOIC ACID GPR40 MODULATORS Amgen, Inc (US) 2010-01-06 EP disclosed
US-7572934-B2 Substituted biphenyl GPR40 modulators AMGEN INC. (US) 2009-08-11 US disclosed
US-20090111859-A1 Substituted biphenyl GPR40 modulators AMGEN INC. (US) 2009-04-30 US disclosed
WO-2008130514-A1 SUBSTITUTED BIPHENYL PHENOXY-, THIOPHENYL- AND AMINOPHENYLPROPANOIC ACID GPR40 MODULATORS AMGEN INC. (US) 2008-10-30 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-20090111859-A1 Substituted biphenyl GPR40 modulators GPR119, GPR65, GPR55 CYP1A2 483/4885SLC7A5 2619/4885PPARG 13/4885

“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.