SCHEMBL30312201

SCHEMBL30312201

CC/C(C)=C\CCC(C)CC=O

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.38
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.35
USP2 O75604 1/20 0.30
KDM1A O60341 1/20 0.30
FNTA P49354 1/20 0.30
FNTB P49356 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
SCHEMBL30312055 1.00 ALOX15 (0.38) ALOX15ALDH1A1TSHRUSP2KDM1A
SCHEMBL11863452 1.00 ALOX15 (0.38) ALOX15ALDH1A1TSHRUSP2KDM1A
SCHEMBL30312052 1.00 ALOX15 (0.38) ALOX15ALDH1A1TSHRUSP2KDM1A
SCHEMBL30312047 1.00 ALOX15 (0.38) ALOX15ALDH1A1TSHRUSP2KDM1A
SCHEMBL11872155 1.00 ALOX15 (0.38) ALOX15ALDH1A1TSHRUSP2KDM1A
SCHEMBL30312070 1.00 ALOX15 (0.38) ALOX15ALDH1A1TSHRUSP2KDM1A
SCHEMBL30312202 1.00 ALOX15 (0.38) ALOX15ALDH1A1TSHRUSP2KDM1A
SCHEMBL27805339 0.85 ALOX15 (0.36) ALOX15ALDH1A1TSHRKDM1AFNTA
SCHEMBL10978446 0.85 ALOX15 (0.42) ALOX15ALDH1A1TSHRUSP2KDM1A
SCHEMBL10978438 0.85 ALOX15 (0.42) ALOX15ALDH1A1TSHRUSP2KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240407983-A1 (R,E)-3,7-DIMETHYLNON-6-ENAL, ISOMERIC MIXTURES OF THE COMPOUND AND THE USE IN PERFUMERY GIVAUDAN SA (CH) 2024-12-12 US disclosed
EP-4412973-A1 (R,E)-3,7-DIMETHYLNON-6-ENAL, ISOMERIC MIXTURES OF THE COMPOUND AND THE USE IN PERFUMERY Givaudan SA (CH) 2024-08-14 EP disclosed
CN-118055916-A (R, E) -3, 7-dimethyl-non-6-enal, isomer mixture of the compound and application in perfume 奇华顿股份有限公司 2024-05-17 CN disclosed
WO-2023057421-A1 (R,E)-3,7-DIMETHYLNON-6-ENAL, ISOMERIC MIXTURES OF THE COMPOUND AND THE USE IN PERFUMERY GIVAUDAN SA (CH) 2023-04-13 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-20240407983-A1 (R,E)-3,7-DIMETHYLNON-6-ENAL, ISOMERIC MIXTURES OF THE COMPOUND AND THE USE IN PERFUMERY CYP2D6, G6PD, ECI1 ALOX15 338/4885ALDH1A1 893/4885TSHR 4208/4885

“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.