SCHEMBL6281574

SCHEMBL6281574

CCC(=O)c1cc2c(cc1OC)OC(C)(C)C=C2C(C)C

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
HMGCR P04035 1/20 0.39
HSP90AA1 P07900 4/20 0.39
HIF1A Q16665 9/20 0.38
KDM4E B2RXH2 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34

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
SCHEMBL6278672 0.86 PPARG (0.43) PPARGPPARAHSP90AA1HIF1AKDM4E
SCHEMBL6278743 0.85 HMGCR (0.42) HMGCRHSP90AA1HIF1AKDM4ECASP1
SCHEMBL6278683 0.84 PPARG (0.41) PPARGPPARAHSP90AA1HIF1A
SCHEMBL6278688 0.84 PPARG (0.41) PPARGPPARAHSP90AA1HIF1A
SCHEMBL6275293 0.82 PPARG (0.37) PPARGPPARAHSP90AA1
SCHEMBL6275291 0.82 PPARG (0.37) PPARGPPARAHSP90AA1
SCHEMBL6275286 0.82 PPARG (0.37) PPARGPPARAHSP90AA1
SCHEMBL6281193 0.81 PPARG (0.38) PPARGPPARA
SCHEMBL6281201 0.81 PPARG (0.38) PPARGPPARA
SCHEMBL6278305 0.81 PPARG (0.36) PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050096380-A1 7-[(7-ALKOXY)-CHROM-3-EN-6-YL]-HEPTATRIENOIC ACID AND 7-[(3-ALKOXY)-5,6-DIHYDRONAPHTHALEN-2-YL]-HEPTATRIENOIC ACID DERIVATIVES HAVING SERUM GLUCOSE REDUCING ACTIVITY ALLERGAN, INC. 2005-05-05 US disclosed
US-6887896-B1 7-[(7-Alkoxy)-chrom-3-en-6-yl]-heptatrienoic acid and 7-[(3-alkoxy)-5,6-dihydronaphthalen-2-yl]-heptatrienoic acid derivatives having serum glucose reducing activity ALLERGAN, INC. (US) 2005-05-03 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 (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-20050096380-A1 7-[(7-ALKOXY)-CHROM-3-EN-6-YL]-HEPTATRIENOIC ACID AND 7-[(3-ALKOXY)-5,6-DIHYDRONAPHTHALEN-2-YL]-HEPTATRIENOIC ACID DERIVATIVES HAVING SERUM GLUCOSE REDUCING ACTIVITY TPO, THRA, FABP6 PPARG 32/4885PPARA 38/4885HMGCR 216/4885

“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.