SCHEMBL271978

SCHEMBL271978

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.38
EPHX1 P07099 3/20 0.35
CA12 O43570 3/20 0.35
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
CA9 Q16790 3/20 0.35
MMP2 P08253 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 2/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
OPRK1 P41145 1/20 0.32
LMNA P02545 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
SCN1A P35498 1/20 0.31
SCN2A Q99250 1/20 0.31
SCN3A Q9NY46 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL23495570 1.00 HCAR2 (0.38) HCAR2EPHX1CA12CA1CA2
SCHEMBL21061211 1.00 HCAR2 (0.38) HCAR2EPHX1CA12CA1CA2
SCHEMBL271977 1.00 HCAR2 (0.38) HCAR2EPHX1CA12CA1CA2
SCHEMBL16505569 0.98 HCAR2 (0.39) HCAR2EPHX1CA12CA1CA2
SCHEMBL16505570 0.98 HCAR2 (0.39) HCAR2EPHX1CA12CA1CA2
SCHEMBL1050591 0.90 HCAR2 (0.47) HCAR2EPHX1CA12CA1CA2
SCHEMBL1050594 0.90 HCAR2 (0.47) HCAR2EPHX1CA12CA1CA2
SCHEMBL8893827 0.85 EPHX1 (0.38) HCAR2EPHX1CA12CA1CA2
SCHEMBL6023045 0.84 HCAR2 (0.60) HCAR2EPHX1CA12CA1CA2
SCHEMBL8896991 0.82 EPHX1 (0.34) HCAR2EPHX1CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12441953-B2 Isomer mixtures of unsaturated macrocyclic musk compounds SYMRISE AG (DE) 2025-10-14 US claimed
CN-111051483-B Esters and ethers of 2, 4-tetramethyl cyclobutane-1, 3-diol as fragrance chemicals 巴斯夫欧洲公司 2025-01-24 CN claimed
US-12187978-B2 Use of (3-acetoxy-2,2-dimethyl-propyl) acetate in combination with (3-hydroxy-2,2-dimethyl-propyl) acetate as an aroma chemical BASF SE (DE) 2025-01-07 US claimed
US-20240173227-A1 A FRAGRANCE MIXTURE CONTAINING ISOCITRONELLOL SYMRISE AG (DE) 2024-05-30 US 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-2430140-A2 PERFUME SYSTEMS The Procter & Gamble Company (US) 2012-03-21 EP claimed
US-12630781-B2 Fragrance or flavour mixture SYMRISE AG (DE) 2026-05-19 US disclosed
US-12625123-B2 Device and method for the analytical and sensory determination of the release of an active substance from a release system SYMRISE AG (DE) 2026-05-12 US disclosed
US-20260096978-A1 A METHOD FOR PREVENTING, MITIGATING AND/OR TREATING PTGS2-INDUCED SKIN DISORDERS AND RELATED DYSFUNCTIONS SYMRISE AG (DE) 2026-04-09 US disclosed
EP-4077299-B1 SUBSTITUTED 4-METHYLENE-TETRAHYDROPYRANS, 4-METHYL-DIHYDROPYRANS AND 4-METHYL-TETRAHYDROPYRANS AND USE THEREOF AS AROMA CHEMICALS BASF SE (DE) 2026-04-01 EP disclosed
US-12590265-B2 1-norbornan-2-ylpropan-2-one as a fragrance SYMRISE AG (DE) 2026-03-31 US disclosed
US-12583833-B2 Enrichment of a diastereomer in Magnolan SYMRISE AG (DE) 2026-03-24 US disclosed
US-20260071137-A1 5,5-DISUBSTITUED TETRAHYDROFURAN-2-ONE AS FRAGRANCE COMPOUNDS SYMRISE AG (DE) 2026-03-12 US disclosed
WO-2007131834-A1 TRISUBSTITUTED FURAN DERIVATIVES AS FRAGRANCES AND AROMA SUBSTANCES SYMRISE GMBH & CO. KG (DE) 2007-11-22 WO disclosed
US-20070254826-A1 Novel uses of 4-methyl-5-hydroxy-hexanoic acid lactone SYMRISE GMBH & CO. KG (DE) 2007-11-01 US disclosed
US-20070072789-A1 2-Methyl-5-phenylpentanal used as a rose odoriferous substance SYMRISE GMBH & CO. KG (DE) 2007-03-29 US disclosed
US-20070037733-A1 Use of 3-cyclohexenyl-1-propanol as a fragrance SYMRISE GMBH & CO. KG (DE) 2007-02-15 US disclosed
US-20060211597-A1 Cis-3,3,5-trimethylcyclohexyl esters SYMRISE AG (DE) 2006-09-21 US disclosed
US-20060166857-A1 4,8-Dimethyl-7-nonen-2-one and 4,8-dimethylnonan-2-one used as perfumes SYMRISE GMBH & CO. KG (DE) 2006-07-27 US disclosed
US-20060135400-A1 4-Cyclohexyl-2-butanol as an odiferous substance SYMRISE GMBH & CO. KG (DE) 2006-06-22 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 (7 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-12583833-B2 Enrichment of a diastereomer in Magnolan TRPA1, ENO1, ADH1A HCAR2 2710/4885EPHX1 425/4885CA12 199/4885
US-12625123-B2 Device and method for the analytical and sensory determination of the release of an active substance from a release system TAS2R7, TAS2R42, TAS2R39 HCAR2 273/4885EPHX1 2373/4885CA12 276/4885
US-12590265-B2 1-norbornan-2-ylpropan-2-one as a fragrance OR10J3, TAS2R40, TAS2R50 HCAR2 270/4885EPHX1 3365/4885CA12 2947/4885
US-20260071137-A1 5,5-DISUBSTITUED TETRAHYDROFURAN-2-ONE AS FRAGRANCE COMPOUNDS PRMT5, ACSL5, ELOVL5 HCAR2 540/4885EPHX1 1125/4885CA12 3966/4885
US-12630781-B2 Fragrance or flavour mixture NOTUM, FFAR2, FFAR1 HCAR2 163/4885EPHX1 789/4885CA12 1246/4885
US-20260096978-A1 A METHOD FOR PREVENTING, MITIGATING AND/OR TREATING PTGS2-INDUCED SKIN DISORDERS AND RELATED DYSFUNCTIONS PTGS2, PTGES2, PTGS1 HCAR2 92/4885EPHX1 236/4885CA12 754/4885
US-20240173227-A1 A FRAGRANCE MIXTURE CONTAINING ISOCITRONELLOL IPO5, OR51E2, FDFT1 HCAR2 2692/4885EPHX1 2321/4885CA12 3671/4885

“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.