SCHEMBL5126743

SCHEMBL5126743

COc1ccc(-c2cccc(Oc3cc(CC(=O)O)cc(OCC4CC4)c3)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 7/20 0.53
FFAR4 Q5NUL3 4/20 0.53
ACACA Q13085 4/20 0.50
ACACB O00763 2/20 0.50
PPARD Q03181 4/20 0.48
PPARA Q07869 1/20 0.47
THRA P10827 1/20 0.46
THRB P10828 1/20 0.46
PTGER4 P35408 1/20 0.45
CTSA P10619 1/20 0.45
FABP1 P07148 1/20 0.44
NR1H4 Q96RI1 1/20 0.42

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
SCHEMBL5132056 0.91 ACACA (0.49) FFAR1FFAR4ACACAACACBPPARD
SCHEMBL5131973 0.89 FFAR1 (0.46) FFAR1FFAR4ACACAACACBPPARD
SCHEMBL5126543 0.88 ACACA (0.44) FFAR1FFAR4ACACAACACBPPARD
SCHEMBL5129275 0.88 PPARD (0.55) FFAR1FFAR4ACACAACACBPPARD
SCHEMBL5129466 0.87 FFAR1 (0.48) FFAR1FFAR4ACACAACACBPPARD
SCHEMBL4435032 0.87 FFAR1 (0.61) FFAR1FFAR4THRATHRBPTGER4
SCHEMBL14605874 0.86 FFAR1 (0.50) FFAR1FFAR4ACACAACACBPPARD
SCHEMBL5122549 0.86 FFAR1 (0.58) FFAR1FFAR4ACACAACACBPPARD
SCHEMBL5129129 0.86 FFAR1 (0.46) FFAR1FFAR4ACACAACACBPPARD
SCHEMBL5129165 0.86 PPARD (0.46) FFAR1FFAR4ACACAACACBPPARD

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
US-20080249137-A1 PPAR active compounds PLEXXIKON INC 2008-10-09 US disclosed
US-20080249137-A1 PPAR active compounds PLEXXIKON INC 2008-10-09 US disclosed
US-20080249137-A1 PPAR active compounds PLEXXIKON INC 2008-10-09 US disclosed
WO-2007030567-A2 PPARACTIVE COMPOUNDS PLEXXIKON, INC. (US) 2007-03-15 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-20080249137-A1 PPAR active compounds PPARG, PPARA, PPARD FFAR1 57/4885FFAR4 60/4885ACACA 46/4885

“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.