SCHEMBL6933381

SCHEMBL6933381

CCCCC/C=C/C/C=C/C/C=C/C/C=C/CCC1OC(=O)C(O)=C1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.45
PPARG P37231 5/20 0.42
ALDH1A1 P00352 5/20 0.42
PPARD Q03181 4/20 0.42
PPARA Q07869 4/20 0.42
F7 P08709 4/20 0.42
F3 P13726 4/20 0.42
FFAR1 O14842 3/20 0.42
KDM4E B2RXH2 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
LMNA P02545 2/20 0.42
CYP3A4 P08684 2/20 0.42
CYP19A1 P11511 2/20 0.42
FABP4 P15090 2/20 0.42
HPGD P15428 2/20 0.42
ALOX15 P16050 2/20 0.42
NR4A2 P43354 2/20 0.42
HSD17B10 Q99714 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
PTGS1 P23219 2/20 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
SCHEMBL6933386 1.00 TRPV1 (0.45) TRPV1PPARGALDH1A1PPARDPPARA
SCHEMBL8775295 1.00 TRPV1 (0.45) TRPV1PPARGALDH1A1PPARDPPARA
SCHEMBL8775359 1.00 TRPV1 (0.45) TRPV1PPARGALDH1A1PPARDPPARA
SCHEMBL8775261 0.94 ABHD16A (0.45) TRPV1PPARGALDH1A1PPARDPPARA
SCHEMBL8775109 0.94 ABHD16A (0.45) TRPV1PPARGALDH1A1PPARDPPARA
SCHEMBL8775255 0.94 ABHD16A (0.45) TRPV1PPARGALDH1A1PPARDPPARA
SCHEMBL8775675 0.94 ABHD16A (0.45) TRPV1PPARGALDH1A1PPARDPPARA
SCHEMBL8990008 0.82 TRPV1 (0.39) TRPV1PPARGALDH1A1PPARDPPARA
SCHEMBL8990022 0.82 TRPV1 (0.39) TRPV1PPARGALDH1A1PPARDPPARA
SCHEMBL8775215 0.82 TRPV1 (0.39) TRPV1PPARGALDH1A1PPARDPPARA

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-1246811-B1 METHODS FOR RESOLVING RACEMIC MIXTURES OF 5-SUBSTITUTED 4-HYDROXY-2-FURANONES OXIS ISLE OF MAN LTD (GB) 2003-12-03 EP disclosed
US-6613919-B2 Resolution with enantiomerically pure bases such as cinchonidine by forming a salt; also 3,4-dihydroxy-2(5H)-furanones OXIS ISLE OF MAN 2003-09-02 US disclosed
US-20030065196-A1 Method for resolving racemic mixtures of 5-substituted 4-hydroxy-2-furanones OXIS ISLE OF MAN 2003-04-03 US disclosed
EP-1246811-A1 METHODS FOR RESOLVING RACEMIC MIXTURES OF 5-SUBSTITUTED 4-HYDROXY-2-FURANONES OXIS Isle of Man, Limited (GB) 2002-10-09 EP disclosed
WO-2001049671-A1 METHODS FOR RESOLVING RACEMIC MIXTURES OF 5-SUBSTITUTED 4-HYDROXY-2-FURANONES OXIS ISLE OF MAN, LIMITED (US) 2001-07-12 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-20030065196-A1 Method for resolving racemic mixtures of 5-substituted 4-hydroxy-2-furanones ADH1C, SRD5A2, SRD5A1 TRPV1 2601/4885PPARG 4664/4885ALDH1A1 311/4885

“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.