SCHEMBL2597416

SCHEMBL2597416

CC=CCCCCCC1CCC(=O)O1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.64
PPARG P37231 2/20 0.40
CA1 P00915 1/20 0.35
CA9 Q16790 1/20 0.35
EPHX2 P34913 1/20 0.34
CYP19A1 P11511 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
ENPP2 Q13822 1/20 0.32
LPAR2 Q9HBW0 1/20 0.32
PRKCA P17252 3/20 0.31
ABHD16A O95870 1/20 0.30

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
SCHEMBL2597466 1.00 CYP1A2 (0.64) CYP1A2PPARGCA1CA9EPHX2
SCHEMBL8578070 1.00 CYP1A2 (0.64) CYP1A2PPARGCA1CA9EPHX2
SCHEMBL8576864 1.00 CYP1A2 (0.64) CYP1A2PPARGCA1CA9EPHX2
SCHEMBL2597438 1.00 CYP1A2 (0.64) CYP1A2PPARGCA1CA9EPHX2
SCHEMBL272754 0.94 CYP1A2 (0.58) CYP1A2PPARGCA1CA9CYP19A1
SCHEMBL19275487 0.87 CYP1A2 (0.53) CYP1A2PPARGCA1CA9
SCHEMBL8573551 0.86 CYP1A2 (0.67) CYP1A2PPARGCA1CA9EPHX2
SCHEMBL8574308 0.86 CYP1A2 (0.67) CYP1A2PPARGCA1CA9EPHX2
SCHEMBL2597398 0.84 CYP1A2 (0.64) CYP1A2PPARGCA1CA9EPHX2
SCHEMBL2597424 0.84 CYP1A2 (0.64) CYP1A2PPARGCA1CA9EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2571380-A1 5-ALKENYL-2-OXO-TETRAHYDROFURANE DERIVATIVES AS FLAVORING COMPOUNDS Firmenich SA (CH) 2013-03-27 EP claimed
US-20130034646-A1 5-ALKENYL-2-OXO-TETRAHYDROFURANE DERIVATIVES AS FLAVORING COMPOUNDS FIRMENICH SA (CH) 2013-02-07 US claimed
WO-2011145048-A1 5-ALKENYL-2-OXO-TETRAHYDROFURANE DERIVATIVES AS FLAVORING COMPOUNDS FIRMENICH SA (CH) 2011-11-24 WO claimed
EP-4583708-A1 ARTHROPOD CONTROL COMPOSITIONS Firmenich SA (CH) 2025-07-16 EP disclosed
WO-2024084006-A1 ARTHROPOD CONTROL COMPOSITIONS FIRMENICH SA (CH) 2024-04-25 WO disclosed
EP-2571380-B1 5-Alkenyl-2-oxo-tetrahydrofurane derivatives as flavoring compounds FIRMENICH & CIE (CH) 2016-04-20 EP disclosed
EP-2571380-A1 5-ALKENYL-2-OXO-TETRAHYDROFURANE DERIVATIVES AS FLAVORING COMPOUNDS Firmenich SA (CH) 2013-03-27 EP disclosed
US-20130034646-A1 5-ALKENYL-2-OXO-TETRAHYDROFURANE DERIVATIVES AS FLAVORING COMPOUNDS FIRMENICH SA (CH) 2013-02-07 US disclosed
WO-2011145048-A1 5-ALKENYL-2-OXO-TETRAHYDROFURANE DERIVATIVES AS FLAVORING COMPOUNDS FIRMENICH SA (CH) 2011-11-24 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-20130034646-A1 5-ALKENYL-2-OXO-TETRAHYDROFURANE DERIVATIVES AS FLAVORING COMPOUNDS FABP5, ACSL5, TAS2R5 CYP1A2 819/4885PPARG 447/4885CA1 3723/4885

“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.