SCHEMBL115296

SCHEMBL115296

CC(C)(C)C(C(=O)O)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 7/20 0.40
SMN1; SMN2 Q16637 4/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.36
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
MMP2 P08253 2/20 0.35
CA9 Q16790 2/20 0.35
DPP4 P27487 1/20 0.35
PDK1 Q15118 1/20 0.35
PDK2 Q15119 1/20 0.35
PDK3 Q15120 1/20 0.35
PDK4 Q16654 1/20 0.35
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL26407314 1.00 EPHX1 (0.40) EPHX1SMN1; SMN2ALDH1A1CYP2C9CYP2C19
SCHEMBL9899213 0.98 SMN1; SMN2 (0.39) EPHX1SMN1; SMN2ALDH1A1CYP2C9CYP2C19
SCHEMBL1903296 0.93 ALDH1A1 (0.35) EPHX1SMN1; SMN2ALDH1A1CYP2C9CYP2C19
SCHEMBL1903480 0.89 ALOX5 (0.31) ALDH1A1MAPT
SCHEMBL28621311 0.85 EPHX1 (0.39) EPHX1SMN1; SMN2ALDH1A1CYP2C9CYP2C19
SCHEMBL24433787 0.81 EPHX1 (0.54) EPHX1ALDH1A1CA12CA1CA2
SCHEMBL10699731 0.81 EPHX1 (0.31) EPHX1CYP2C9CYP2C19
SCHEMBL22758121 0.81 EPHX1 (0.54) EPHX1ALDH1A1CA12CA1CA2
SCHEMBL2979622 0.80 SHBG (0.38) EPHX1SMN1; SMN2ALDH1A1CYP2C9CYP2C19
SCHEMBL4612561 0.80 EPHX1 (0.35) EPHX1SMN1; SMN2ALDH1A1CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3624762-B1 PERFUMING COMPOSITIONS GIVAUDAN SA (CH) 2025-01-08 EP claimed
EP-3383359-A1 A FRAGRANCE COMPOSITION Symrise AG (DE) 2018-10-10 EP claimed
WO-2017097438-A1 A FRAGRANCE COMPOSITION SYMRISE AG (DE) 2017-06-15 WO claimed
WO-2017097434-A1 A FRAGRANCE COMPOSITION SYMRISE AG (DE) 2017-06-15 WO claimed
CN-105646175-A Buparvaquone synthesis process 吕艳 2016-06-08 CN claimed
EP-2134377-A1 FRAGRANCE DISPENSER Symrise GmbH & Co. KG (DE) 2009-12-23 EP claimed
WO-2008104226-A1 FRAGRANCE DISPENSER SYMRISE GMBH & CO. KG (DE) 2008-09-04 WO claimed
EP-1170343-B1 INFRARED SENSITIVE COATING LIQUID ASAHI KASEI CHEMICALS CORP (JP) 2005-11-02 EP claimed
EP-0955035-B1 Method of preventing aged body odor SHISEIDO CO LTD (JP) 2004-09-29 EP claimed
WO-2026041220-A1 FRAGRANCES WITH NEW ODOR MIXTURES AND USE THEREOF IN PERFUMERY SYMRISE AG (DE) 2026-02-26 WO disclosed
CN-119923291-A Mixed microcapsules 弗门尼舍有限公司 2025-05-02 CN disclosed
CN-119562853-A Composite microcapsule 弗门尼舍有限公司 2025-03-04 CN disclosed
CN-119529947-A Microcapsule for encapsulating core material and preparation method thereof 广州立白企业集团有限公司 2025-02-28 CN disclosed
CN-119351173-A Microcapsule for encapsulating core material and preparation method thereof 广州立白企业集团有限公司 2025-01-24 CN disclosed
EP-0137419-A2 Perfume compositions containing benzyl ethers L. GIVAUDAN & CIE Société Anonyme (CH) 1985-04-17 EP disclosed
EP-0116277-A2 Ketones of bicyclic compounds, process for their preparation, odorant and/or flavouring compositions containing such compounds L. GIVAUDAN & CIE Société Anonyme (CH) 1984-08-22 EP disclosed
EP-0010142-B1 SESQUITERPENOID TETRAHYDROFURAN DERIVATIVES (I) AS ISOLATED COMPOUNDS OR IN THE FORM OF MIXTURES, PROCESS AND STARTING MATERIALS (V) FOR THEIR PREPARATION, APPLICATION OF (I) AS PERFUMES AND/OR FLAVORS AND PERFUME AND/OR FLAVOR COMPOSITIONS WITH AN AMOUNT OF (I) L. Givaudan & Cie Société Anonyme (CH) 1981-07-22 EP disclosed
EP-0012246-A1 Aromatic and flavouring substances, their preparation by fermentation, their use and products containing them L. Givaudan & Cie Société Anonyme (CH) 1980-06-25 EP disclosed
EP-0010142-A1 Sesquiterpenoid tetrahydrofuran derivatives (I) as isolated compounds or in the form of mixtures, process and starting materials (V) for their preparation, application of (I) as perfumes and/or flavors and perfume and/or flavor compositions with an amount of (I) L. Givaudan & Cie Société Anonyme (CH) 1980-04-30 EP disclosed
EP-0005196-A1 Octylcyclohexane derivatives, their preparation and their use as perfuming agents BASF Aktiengesellschaft (DE) 1979-11-14 EP disclosed