SCHEMBL3004869

SCHEMBL3004869

C=CC(O)C=CC=CCCCC

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.43
GPR132 Q9UNW8 1/20 0.43
ABCG2 Q9UNQ0 2/20 0.42
PTGS1 P23219 1/20 0.42
OPRK1 P41145 1/20 0.42
MEN1 O00255 1/20 0.41
CYP3A4 P08684 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 2/20 0.38
TSHR P16473 2/20 0.38
FASN P49327 1/20 0.38
LTB4R2 Q9NPC1 1/20 0.38
ALOX5 P09917 1/20 0.38
MAPT P10636 1/20 0.38
OXER1 Q8TDS5 1/20 0.37
FAAH O00519 1/20 0.37

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
SCHEMBL3004862 1.00 PPARG (0.43) PPARGGPR132ABCG2PTGS1OPRK1
SCHEMBL7946487 0.83 ALOX5 (0.55) LTB4R2ALOX5MAPTOXER1FAAH
SCHEMBL3010270 0.81 PPARG (0.43) PPARGGPR132MEN1CYP3A4KMT2A
SCHEMBL3011766 0.81 PPARG (0.43) PPARGGPR132MEN1CYP3A4KMT2A
SCHEMBL3006631 0.81 PPARG (0.43) PPARGGPR132MEN1CYP3A4KMT2A
SCHEMBL3006627 0.81 PPARG (0.43) PPARGGPR132MEN1CYP3A4KMT2A
SCHEMBL10431313 0.78 PPARG (0.38) PPARGGPR132
SCHEMBL8418619 0.78 ABCG2 (0.60) PPARGABCG2PTGS1OPRK1MEN1
SCHEMBL8418621 0.78 ABCG2 (0.60) PPARGABCG2PTGS1OPRK1MEN1
SCHEMBL3002177 0.78 PPARG (0.51) PPARGGPR132ALDH1A1FASNLTB4R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100191019-A1 Organic Compounds GIVAUDAN SA (CH) 2010-07-29 US claimed
EP-2178399-A1 ORGANIC COMPOUNDS Givaudan SA (CH) 2010-04-28 EP claimed
WO-2009009916-A1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2009-01-22 WO claimed
US-20100191019-A1 Organic Compounds GIVAUDAN SA (CH) 2010-07-29 US disclosed
EP-2178399-A1 ORGANIC COMPOUNDS Givaudan SA (CH) 2010-04-28 EP disclosed
WO-2009009916-A1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2009-01-22 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-20100191019-A1 Organic Compounds OR10J3, ALOX5, OR51E2 PPARG 115/4885GPR132 3709/4885ABCG2 349/4885

“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.