SCHEMBL933394

SCHEMBL933394

CC1=CCCC(C)(C)C1CCC(C)C=O

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.30
▸ GAA P10253 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
SCHEMBL4773549 0.88 ALOX15 (0.35) ALOX15ALDH1A1CYP3A4TDP1
Cinnamaldehyde SCHEMBL15618525 0.85 ALDH1A1 (0.38) ALOX15ALDH1A1CYP3A4TDP1
SCHEMBL4078385 0.83 ALOX15 (0.40) ALOX15ALDH1A1CYP3A4TDP1
SCHEMBL1825823 0.80 ALOX15 (0.40) ALOX15ALDH1A1CYP3A4TDP1
SCHEMBL16268485 0.79 ALOX15 (0.37) ALOX15ALDH1A1CYP3A4TDP1
SCHEMBL2707207 0.78 ALOX15 (0.41) ALOX15ALDH1A1CYP3A4TDP1
SCHEMBL13751513 0.78 ALOX15 (0.39) ALOX15ALDH1A1CYP3A4TDP1
SCHEMBL4773561 0.75 ALOX15 (0.37) ALOX15ALDH1A1CYP3A4TDP1
SCHEMBL1305568 0.74 ALOX15 (0.44) ALOX15ALDH1A1CYP3A4TDP1KDM4E
SCHEMBL4447005 0.74 ALOX15 (0.42) ALOX15ALDH1A1CYP3A4TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4446001-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS Givaudan SA (CH) 2024-10-16 — — EP claimed
WO-2018145219-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING AND TREATING ADDICTIONS BY MEANS OF AVERSIVE COUNTERCONDITIONING SERANI MOSTAZAL JORGE (CL) 2018-08-16 — — WO claimed
EP-2655307-B1 COMPOUNDS CAPABLE OF RELEASING FRAGRANT COMPOUNDS GIVAUDAN SA (CH) 2018-08-01 — — EP claimed
US-9845449-B2 Stabilized perfume oils HENKEL AG & CO. KGAA (DE) 2017-12-19 — — US claimed
US-9193935-B2 Compounds capable of releasing fragrant compounds GIVAUDAN S.A. (CH) 2015-11-24 — — US claimed
US-8680040-B2 1-aza-3,7-dioxabicyclo[3,3,0]octane compounds and monocyclic oxazolidines as pro-fragrances HENKEL AG & CO. KGAA (DE) 2014-03-25 — — US claimed
US-20130316938-A1 Compounds Capable Of Releasing Fragrant Compounds GIVAUDAN S.A. (CH) 2013-11-28 — — US claimed
EP-2655307-A1 COMPOUNDS CAPABLE OF RELEASING FRAGRANT COMPOUNDS Givaudan SA (CH) 2013-10-30 — — EP claimed
CN-103319521-A Cyclic siloxane compositions for the release of active ingredients GEN ELECTRIC 2013-09-25 — — CN claimed
EP-2032516-B1 FRAGRANCE COMPOUNDS GIVAUDAN SA (CH) 2012-09-26 — — EP claimed
WO-2006102777-A1 SKIN LIGHTENING METHODS, COMPOSITIONS AND PRODUCTS GIVAUDAN SA (CH) 2006-10-05 — — WO claimed
EP-1697386-A1 ACTIVE INGREDIENT-RELEASING CYCLIC SILOXANES General Electric Company A Corporation of the State of New York (US) 2006-09-06 — — EP claimed
WO-2006085048-A2 PRO-FRAGRANCE AND PRO-FLAVORANT COMPOSITIONS FLEXITRAL, INC. (US) 2006-08-17 — — WO claimed
WO-2005108541-A1 WASHING COMPOSITIONS GIVAUDAN SA (CH) 2005-11-17 — — WO claimed
WO-2005066187-A1 ACTIVE INGREDIENT-RELEASING CYCLIC SILOXANES GENERAL ELECTRIC COMPANY (US) 2005-07-21 — — WO claimed
WO-2005066186-A2 CYCLIC SILOXANE COMPOSITIONS FOR THE RELEASE OF ACTIVE INGREDIENTS GENERAL ELECTRIC COMPANY (US) 2005-07-21 — — WO claimed
US-20050136022-A1 Cyclic siloxane compositions for the release of active ingredients MOMENTIVE PERFORMANCE MATERIALS INC. 2005-06-23 — — US claimed
US-20050136021-A1 Active-releasing cyclic siloxanes MOMENTIVE PERFORMANCE MATERIALS INC. 2005-06-23 — — US claimed
EP-0980863-A1 Oxime carboxylic acid derivatives Givaudan Roure (International) S.A. (CH) 2000-02-23 — — EP claimed
EP-0878497-A2 Fragrance precursor compounds GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1998-11-18 — — EP 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 (2 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-20050136022-A1 Cyclic siloxane compositions for the release of active ingredients F9, RPL39, ECPAS ALOX15 868/4885ALDH1A1 44/4885CYP3A4 1847/4885
US-20050136021-A1 Active-releasing cyclic siloxanes F9, RPL39, ALDH16A1 ALOX15 797/4885ALDH1A1 57/4885CYP3A4 2149/4885

“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.

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