SCHEMBL5770302

SCHEMBL5770302

CC(C)=CCC(C)CC=O

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.38
TSHR P16473 1/20 0.38
ALDH1A1 P00352 3/20 0.37
GRIK1 P39086 1/20 0.35
GRIK2 Q13002 1/20 0.35
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31

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
SCHEMBL8388179 0.87 ALOX15 (0.44) ALOX15TSHRALDH1A1GRIK1GRIK2
SCHEMBL31538293 0.81
SCHEMBL19741477 0.81 ALDH1A1 (0.38) TSHRALDH1A1
SCHEMBL159060 0.81
SCHEMBL11797888 0.80 ALOX15 (0.38) ALOX15TSHRALDH1A1GRIK1GRIK2
SCHEMBL13524793 0.80 ALOX15 (0.38) ALOX15TSHRALDH1A1GRIK1GRIK2
SCHEMBL11872578 0.79
Citronellal SCHEMBL457495 0.79 ALOX15 (0.57) ALOX15TSHRALDH1A1
Citronellal SCHEMBL29275 0.79 ALOX15 (0.57) ALOX15TSHRALDH1A1
SCHEMBL11872569 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025094045-A1 PROCESS FOR PREPARATION OF ODOROUS COMPOUNDS S H KELKAR AND COMPANY LIMITED (IN) 2025-05-08 WO disclosed
CN-106010788-B Novel aldehyde compounds and their use in perfuming compositions 国际香料和香精公司 2021-04-23 CN disclosed
US-10150722-B2 Aldehyde compounds and their use in perfume compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2018-12-11 US disclosed
EP-3072876-B1 ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS INT FLAVORS & FRAGRANCES INC (US) 2018-10-10 EP disclosed
US-20180057436-A1 NOVEL ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2018-03-01 US disclosed
US-20180057436-A1 NOVEL ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2018-03-01 US disclosed
US-9850191-B2 Aldehyde compounds and their use in perfume compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2017-12-26 US disclosed
US-9850191-B2 Aldehyde compounds and their use in perfume compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2017-12-26 US disclosed
US-9850191-B2 Aldehyde compounds and their use in perfume compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2017-12-26 US disclosed
US-20160281027-A1 NOVEL ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2016-09-29 US disclosed
US-20160281027-A1 NOVEL ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2016-09-29 US disclosed
US-20160281027-A1 NOVEL ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2016-09-29 US disclosed
EP-3072876-A1 ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS Closson, Adam P. (US) 2016-09-28 EP disclosed
EP-3072876-A1 ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS Closson, Adam P. (US) 2016-09-28 EP disclosed
EP-1714637-A2 Stable composition for hair dye comprising a fragrance Takasago International Corporation (JP) 2006-10-25 EP disclosed
US-3970704-A Alkoxy substituted aliphatic di-olefinic halides ZOECON CORPORATION (US) 1976-07-20 US disclosed
US-3948996-A Novel products ZOECON CORPORATION (US) 1976-04-06 US 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 (3 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-20180057436-A1 NOVEL ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS ALDH1A1, TRPA1, ALDH2 ALOX15 45/4885TSHR 4879/4885ALDH1A1 1/4885
US-10150722-B2 Aldehyde compounds and their use in perfume compositions ALDH1A1, ALDH2, ADH5 ALOX15 45/4885TSHR 4881/4885ALDH1A1 1/4885
US-20160281027-A1 NOVEL ALDEHYDE COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS ALDH1A1, TRPA1, ALDH2 ALOX15 45/4885TSHR 4879/4885ALDH1A1 1/4885

“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.