SCHEMBL5580481

SCHEMBL5580481

Cc1c(CC(=O)O)cccc1-c1cccc(OC/C=C/c2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.42
CD274 Q9NZQ7 1/20 0.41
PPARG P37231 6/20 0.41
PTGES O14684 1/20 0.41
ALOX5 P09917 1/20 0.41
PSEN1 P49768 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
PPARD Q03181 7/20 0.40
S1PR5 Q9H228 3/20 0.39
PPARA Q07869 6/20 0.39
MCL1 Q07820 1/20 0.39
RXRA P19793 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
SCHEMBL5580487 1.00 PTGS2 (0.42) PTGS2CD274PPARGPTGESALOX5
SCHEMBL5580460 0.89 PPARD (0.42) PPARGPTGESALOX5PSEN1NPC1
SCHEMBL5580463 0.89 PPARD (0.42) PPARGPTGESALOX5PSEN1NPC1
SCHEMBL5584038 0.88 NR1H2 (0.41) PPARGPTGESALOX5PSEN1NPC1
SCHEMBL5584040 0.88 NR1H2 (0.41) PPARGPTGESALOX5PSEN1NPC1
SCHEMBL3508623 0.86 PPARG (0.43) PPARGPTGESALOX5PSEN1NPC1
SCHEMBL3508626 0.86 PPARG (0.43) PPARGPTGESALOX5PSEN1NPC1
SCHEMBL5580737 0.84 PPARD (0.41) PPARGPTGESALOX5PSEN1NPC1
SCHEMBL5580733 0.84 PPARD (0.41) PPARGPTGESALOX5PSEN1NPC1
SCHEMBL5580704 0.84 S1PR5 (0.39) PPARGPTGESALOX5PSEN1NPC1

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-20070105959-A1 Cynnamyl alcohol derivative compounds and drugs containing the compounds as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2007-05-10 US disclosed
EP-1604971-A1 CINNAMYL ALCOHOL DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2005-12-14 EP 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-20070105959-A1 Cynnamyl alcohol derivative compounds and drugs containing the compounds as active ingredient LPL, GPR119, EBP PTGS2 1407/4885CD274 3969/4885PPARG 14/4885

“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.