SCHEMBL291275

SCHEMBL291275

CC(C)(C)CC(=O)OC1CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.51
HTT P42858 3/20 0.50
CYP2C19 P33261 1/20 0.49
EPHX1 P07099 3/20 0.47
CYP19A1 P11511 5/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
KDM4E B2RXH2 1/20 0.43
APOBEC3A P31941 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
EPHX2 P34913 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
CACNA1B Q00975 1/20 0.35

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
Acetic Acid SCHEMBL28606205 0.94 NAAA (0.47) NAAAHTTCYP2C19EPHX1CYP19A1
SCHEMBL9101438 0.90 APOBEC3A (0.44) NAAAHTTCYP2C19EPHX1CYP19A1
SCHEMBL6576698 0.83 NAAA (0.51) NAAAHTTCYP2C19EPHX1CYP19A1
SCHEMBL17819382 0.82 CYP19A1 (0.47) NAAAHTTCYP2C19EPHX1CYP19A1
SCHEMBL8716143 0.82 SMYD3 (0.40) NAAAHTTCYP2C19EPHX1CYP19A1
SCHEMBL4781362 0.82 CYP19A1 (0.37) NAAAHTTEPHX1CYP19A1SMN1; SMN2
SCHEMBL13779872 0.81 NAAA (0.57) NAAAHTTCYP2C19EPHX1CYP19A1
SCHEMBL23518510 0.79 APOBEC3A (0.38) NAAAHTTCYP2C19EPHX1CYP19A1
SCHEMBL7399719 0.79 CYP19A1 (0.36) NAAAHTTCYP2C19CYP19A1SMN1; SMN2
SCHEMBL8980126 0.79 NAAA (0.47) NAAAHTTCYP2C19EPHX1CYP19A1

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 999 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240173227-A1 A FRAGRANCE MIXTURE CONTAINING ISOCITRONELLOL SYMRISE AG (DE) 2024-05-30 US claimed
CN-117412735-A Composition for limiting, reducing or eliminating malodour associated with plastics material 弗门尼舍有限公司 2024-01-16 CN claimed
CN-117384713-A Laundry detergent composition comprising graft copolymer and benefit agent 宝洁公司 2024-01-12 CN claimed
CN-112135602-B Deodorant and passivating agent 株式会社资生堂 2023-08-01 CN claimed
CN-116507709-A Improvements in or relating to organic compounds 奇华顿股份有限公司 2023-07-28 CN claimed
CN-116171145-A Absorbent article 尤妮佳股份有限公司 2023-05-26 CN claimed
CN-115942990-A Improvements in or relating to organic compounds 奇华顿股份有限公司 2023-04-07 CN claimed
CN-115666494-A Encapsulated compositions comprising core-shell microcapsules and methods of making the same 奇华顿股份有限公司 2023-01-31 CN claimed
CN-115551986-A Fragrance composition 奇华顿股份有限公司 2022-12-30 CN claimed
CN-109689848-B Fragrance composition 奇华顿股份有限公司 2022-12-23 CN claimed
WO-2003066006-A1 METHOD AND COMPOSITION FOR DIMINISHING LOSS OF COLOR IN FLAVORS AND FRAGRANCES CITRUS AND ALLIED ESSENCES, LTD. (US) 2003-08-14 WO claimed
US-20030139312-A1 Highly concentrated fabric softener compositions and articles containing such compositions PROCTER & GAMBLE COMPANY, THE 2003-07-24 US claimed
US-20030036489-A1 Consumable composition comprising perfumed particles and article containing the same THE PROCTER & GAMBLE COMPANY 2003-02-20 US claimed
EP-1280882-A1 HIGHLY CONCENTRATED FABRIC SOFTENER COMPOSITIONS AND ARTICLES CONTAINING SUCH COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2003-02-05 EP claimed
WO-2002090479-A1 PERFUMED PARTICLES AND ARTICLES CONTAINING THE SAME THE PROCTER & GAMBLE COMPANY (US) 2002-11-14 WO claimed
WO-2002090481-A1 COMPOSITIONS AND ARTICLES FOR EFFECTIVE DEPOSITION OF PERFUME THE PROCTER & GAMBLE COMPANY (US) 2002-11-14 WO claimed
WO-2001085892-A1 HIGHLY CONCENTRATED FABRIC SOFTENER COMPOSITIONS AND ARTICLES CONTAINING SUCH COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2001-11-15 WO claimed
US-5733535-A Topical compositions containing N-acetylcysteine and odor masking materials THE PROCTER & GAMBLE CO. (US) 1998-03-31 US claimed
WO-1997015283-A1 TOPICAL COMPOSITIONS CONTAINING N-ACETYLCYSTEINE AND ODOR MASKING MATERIALS THE PROCTER & GAMBLE COMPANY (US) 1997-05-01 WO claimed
US-5445747-A Containing fabric softener, perfume selected to cover odors THE PROCTER & GAMBLE COMPANY (US) 1995-08-29 US claimed

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-20240173227-A1 A FRAGRANCE MIXTURE CONTAINING ISOCITRONELLOL IPO5, OR51E2, FDFT1 NAAA 2759/4885HTT 1556/4885CYP2C19 791/4885

“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.