SCHEMBL6056887

SCHEMBL6056887

OC1C(C2CCCC2)CCC1C1CCCC1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.39
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
PKM P14618 1/20 0.34
SLC18A3 Q16572 1/20 0.31
HSD17B10 Q99714 1/20 0.30
CTDSP1 Q9GZU7 1/20 0.30
HSD11B1 P28845 1/20 0.30
HSD11B2 P80365 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
SCHEMBL6331251 0.97 ALDH1A1 (0.41) ALDH1A1TSHRCA1CA2CA4
SCHEMBL6328019 0.97 ALDH1A1 (0.41) ALDH1A1TSHRCA1CA2CA4
SCHEMBL16617790 0.88 CTDSP1 (0.39) ALDH1A1TSHRCA1CA2CA4
SCHEMBL6355777 0.83 CA1 (0.36) ALDH1A1TSHRCA1CA2CA4
SCHEMBL8254998 0.81 ALDH1A1 (0.39) ALDH1A1TSHRHSD17B10CTDSP1HSD11B1
SCHEMBL16625925 0.79 TSHR (0.41) ALDH1A1TSHRPKMCTDSP1HSD11B1
SCHEMBL810971 0.77 CA1 (0.36) ALDH1A1TSHRCA1CA2CA4
SCHEMBL16625923 0.77 TSHR (0.38) ALDH1A1TSHRCA1CA2CA4
SCHEMBL6346433 0.77 CA1 (0.42) ALDH1A1TSHRCA1CA2CA4
SCHEMBL16625922 0.75 TSHR (0.38) TSHRHSD17B10CTDSP1HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1260572-B1 High-purity cyclopentanone derivatives, process for preparing same, and perfume composition ZEON CORP (JP) 2006-05-03 EP claimed
US-6653276-B2 A cyclopentanone or cyclopentanol compound having 2,5-dicyclopentylidene substituents, 2,5- dicyclopentyl substituents or 2-cyclopentylidene-5-cyclopentyl substituents; useful as perfume emitting floral fragrance ZEON CORPORATION (JP) 2003-11-25 US claimed
US-20030012799-A1 High-purity cyclopentane compound having oxygen-containing group, process for preparing same, and perfume composition ZEON CORPORATION (JP) 2003-01-16 US claimed
EP-1260572-A1 High-purity cyclopentanone derivatives, process for preparing same, and perfume composition Zeon Corporation (JP) 2002-11-27 EP claimed
CN-112062649-B Alkyl-substituted polycyclic biomass high-density aviation fuel and preparation method thereof 西安交通大学 2021-05-28 CN disclosed
CN-112062649-A Alkyl-substituted polycyclic biomass high-density aviation fuel and preparation method thereof 西安交通大学 2020-12-11 CN disclosed
EP-1260572-B1 High-purity cyclopentanone derivatives, process for preparing same, and perfume composition ZEON CORP (JP) 2006-05-03 EP disclosed
US-6653276-B2 A cyclopentanone or cyclopentanol compound having 2,5-dicyclopentylidene substituents, 2,5- dicyclopentyl substituents or 2-cyclopentylidene-5-cyclopentyl substituents; useful as perfume emitting floral fragrance ZEON CORPORATION (JP) 2003-11-25 US disclosed
US-6653276-B2 A cyclopentanone or cyclopentanol compound having 2,5-dicyclopentylidene substituents, 2,5- dicyclopentyl substituents or 2-cyclopentylidene-5-cyclopentyl substituents; useful as perfume emitting floral fragrance ZEON CORPORATION (JP) 2003-11-25 US disclosed
US-20030012799-A1 High-purity cyclopentane compound having oxygen-containing group, process for preparing same, and perfume composition ZEON CORPORATION (JP) 2003-01-16 US disclosed
US-20030012799-A1 High-purity cyclopentane compound having oxygen-containing group, process for preparing same, and perfume composition ZEON CORPORATION (JP) 2003-01-16 US disclosed
EP-1260572-A1 High-purity cyclopentanone derivatives, process for preparing same, and perfume composition Zeon Corporation (JP) 2002-11-27 EP disclosed
EP-1260572-A1 High-purity cyclopentanone derivatives, process for preparing same, and perfume composition Zeon Corporation (JP) 2002-11-27 EP 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 (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-20030012799-A1 High-purity cyclopentane compound having oxygen-containing group, process for preparing same, and perfume composition DHPS, DOHH, PORCN ALDH1A1 1835/4885TSHR 4881/4885CA1 3486/4885

“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.