SCHEMBL19789577

SCHEMBL19789577

COc1cc(CO)ccc1OC=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.48
TTR P02766 1/20 0.48
POLB P06746 3/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 1/20 0.48
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 3/20 0.46
LDHA P00338 1/20 0.46
PPARG P37231 1/20 0.46
PPARD Q03181 1/20 0.46
PPARA Q07869 1/20 0.46
HTT P42858 2/20 0.46
ACHE P22303 1/20 0.46
ERN1 O75460 1/20 0.46
PTGS1 P23219 1/20 0.44
ATM Q13315 1/20 0.43
CA1 P00915 2/20 0.43
CA9 Q16790 2/20 0.43
CA12 O43570 1/20 0.43
LMNA P02545 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
SCHEMBL29639720 1.00 CA2 (0.48) CA2TTRPOLBNPC1RAB9A
SCHEMBL20734996 0.84 CA2 (0.50) CA2POLBKDM4EALDH1A1LDHA
SCHEMBL28170408 0.83 CA2 (0.68) CA2POLBNPC1RAB9AKDM4E
SCHEMBL29997296 0.83 CA2 (0.68) CA2POLBNPC1RAB9AKDM4E
SCHEMBL119395 0.83 CA2 (0.68) CA2POLBNPC1RAB9AKDM4E
SCHEMBL23458348 0.83 CA2 (0.48) CA2POLBKDM4EALDH1A1LDHA
SCHEMBL29640498 0.83 CA2 (0.48) CA2POLBKDM4EALDH1A1LDHA
SCHEMBL24273666 0.81 CA2 (0.47) CA2TTRPOLBNPC1RAB9A
SCHEMBL2818747 0.81 ATM (0.50) CA2POLBNPC1RAB9AKDM4E
Methane SCHEMBL7067208 0.81 CA2 (0.65) CA2POLBNPC1RAB9AKDM4E

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-12252465-B2 Enol ether properfume FIRMENICH SA (CH) 2025-03-18 US disclosed
US-20240059640-A1 Enol Ether Properfume FIRMENICH SA (CH) 2024-02-22 US disclosed
EP-4007748-A1 ENOL ETHER PROPERFUME Firmenich SA (CH) 2022-06-08 EP disclosed
CN-114502704-A Enol ether pro-fragrances 弗门尼舍有限公司 2022-05-13 CN disclosed
WO-2021110680-A1 ENOL ETHER PROPERFUME FIRMENICH SA (CH) 2021-06-10 WO disclosed
EP-2347754-B1 Oral and tooth care and cleaning agents with alkylpyridinium salts I HENKEL AG & CO KGAA (DE) 2018-01-24 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 (2 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-12252465-B2 Enol ether properfume CYP2E1, ETFB, ECI1 CA2 4316/4885TTR 2422/4885POLB 1172/4885
US-20240059640-A1 Enol Ether Properfume CYP2E1, ETFB, ECI1 CA2 4316/4885TTR 2422/4885POLB 1172/4885

“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.