SCHEMBL6294277

SCHEMBL6294277

CCOC(=O)/C=C(C)/C=C/C=C(/CC)c1cc2c(cc1OC)OC(C)(C)C=C2C(C)C

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.34
PPARA Q07869 1/20 0.34
RARG P13631 4/20 0.34
RXRA P19793 4/20 0.34
RARA P10276 2/20 0.34
RARB P10826 2/20 0.34
RXRB P28702 2/20 0.34
RXRG P48443 2/20 0.34
ESR1 P03372 1/20 0.30
PGR P06401 1/20 0.30
ADORA3 P0DMS8 1/20 0.30
CHRM1 P11229 1/20 0.30
PTGS1 P23219 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
OPRM1 P35372 1/20 0.30
KCNH2 Q12809 1/20 0.30
MAOB P27338 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
SCHEMBL6293499 0.93 RXRA (0.38) PPARGPPARARARGRXRARARA
SCHEMBL6295681 0.92 RXRA (0.42) PPARGPPARARARGRXRARARA
SCHEMBL6278794 0.91 RXRA (0.43) PPARGPPARARARGRXRARARA
SCHEMBL6283503 0.85 RXRA (0.47) PPARGPPARARARGRXRARARA
SCHEMBL6303240 0.85 RXRA (0.47) PPARGPPARARARGRXRARARA
SCHEMBL6296880 0.84 RXRA (0.40) PPARGRARGRXRARARARARB
SCHEMBL6299184 0.84 PPARG (0.34) PPARGPPARA
SCHEMBL6281391 0.80 RXRA (0.55) PPARGRARGRXRARARARARB
SCHEMBL6297983 0.80 RXRA (0.37) PPARGRARGRXRARARARARB
SCHEMBL6300016 0.79 RXRA (0.43) PPARGRARGRXRARARARARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005042509-A1 7-`(7-ALKOXY)-CHROM-3-EN-6-YL!-HEPTATRIENOIC ACID AND 7-`(3­ALKOXY)-5,6-DIHYDRONAPHTHALEN-2-YL!-HEPTATRIENOIC ACID DERIVATIVES MODULATORS ALLERGAN, INC. (US) 2005-05-12 WO disclosed
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 38/4885RARG 144/4885

“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.