SCHEMBL30106809

SCHEMBL30106809

CC(C)=CCC[C@]1(C)C=CC(=O)O1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.53
PTGS1 P23219 1/20 0.53
PPARG P37231 1/20 0.51
SLC6A2 P23975 2/20 0.48
TRPA1 O75762 1/20 0.48
LDHA P00338 1/20 0.48
CNR1 P21554 1/20 0.48
SLC6A4 P31645 1/20 0.48
CNR2 P34972 1/20 0.48
SLC6A3 Q01959 1/20 0.48
TRPM8 Q7Z2W7 1/20 0.48
TRPV1 Q8NER1 1/20 0.48
TRPV3 Q8NET8 1/20 0.48
TRPV4 Q9HBA0 1/20 0.48
TRPV2 Q9Y5S1 1/20 0.48
APP P05067 2/20 0.47
PTPN1 P18031 1/20 0.45
HRH1 P35367 1/20 0.45
OPRM1 P35372 1/20 0.45
MAPT P10636 3/20 0.43

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
SCHEMBL27191000 1.00 ALOX5 (0.53) ALOX5PTGS1PPARGSLC6A2TRPA1
SCHEMBL15320516 0.77 ALOX5 (0.51) ALOX5PTGS1PPARGSLC6A2TRPA1
SCHEMBL15989476 0.76 PPARG (0.48) ALOX5PTGS1PPARGSLC6A2TRPA1
SCHEMBL15321103 0.75 ALOX5 (0.49) ALOX5PTGS1PPARGSLC6A2TRPA1
SCHEMBL15335416 0.74 PPARG (0.57) ALOX5PTGS1PPARGSLC6A2TRPA1
SCHEMBL12244543 0.74 APP (0.56) ALOX5PTGS1PPARGSLC6A2TRPA1
SCHEMBL23987190 0.74 APP (0.63) ALOX5PTGS1SLC6A2TRPA1LDHA
SCHEMBL697309 0.74
SCHEMBL28992256 0.73 APP (0.55) ALOX5PTGS1PPARGSLC6A2TRPA1
Cordiachromene A SCHEMBL16666288 0.72 PTGS1 (0.68) ALOX5PTGS1SLC6A2TRPA1LDHA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240271058-A1 USE OF 5-METHYL-5-(4-METHYL-3-PENTEN-1-YL)-2(5H)-FURANONE AS AROMA CHEMICAL BASF SE (DE) 2024-08-15 US disclosed
CN-117413043-A Use of 5-methyl-5- (4-methyl-3-penten-1-yl) -2 (5H) -furanone as an aroma chemical 巴斯夫欧洲公司 2024-01-16 CN disclosed
WO-2022253709-A1 USE OF 5-METHYL-5-(4-METHYL-3-PENTEN-1-YL)-2(5H)-FURANONE AS AROMA CHEMICAL BASF SE (DE) 2022-12-08 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-20240271058-A1 USE OF 5-METHYL-5-(4-METHYL-3-PENTEN-1-YL)-2(5H)-FURANONE AS AROMA CHEMICAL TAS2R5, AAK1, KCNK5 ALOX5 932/4885PTGS1 1030/4885PPARG 1599/4885

“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.