SCHEMBL6281554

SCHEMBL6281554

CCCOc1cc2c(cc1C(C)=O)C(C(C)(C)C)=CCC2(C)C

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RXRA P19793 10/20 0.40
RARG P13631 2/20 0.40
RARA P10276 1/20 0.40
RARB P10826 1/20 0.40
RXRB P28702 1/20 0.40
RXRG P48443 1/20 0.40
CA9 Q16790 2/20 0.40
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
CYSLTR2 Q9NS75 2/20 0.33
CYSLTR1 Q9Y271 2/20 0.33
PPARG P37231 2/20 0.33
NR1H3 Q13133 1/20 0.33
ALK Q9UM73 1/20 0.33
HNF4A P41235 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL6275714 0.91 TSHR (0.47) RXRARARGRARARARBRXRB
SCHEMBL6282940 0.87 RXRA (0.38) RXRARARGRARARARBRXRB
SCHEMBL6279894 0.87 RXRA (0.38) RXRARARGRARARARBRXRB
SCHEMBL6278383 0.85 RXRA (0.37) RXRARARGRARARARBRXRB
SCHEMBL6278386 0.85 RXRA (0.37) RXRARARGRARARARBRXRB
SCHEMBL6277133 0.84 RXRA (0.33) RXRARARGRARARARBRXRB
SCHEMBL6277136 0.84 RXRA (0.33) RXRARARGRARARARBRXRB
SCHEMBL6363628 0.82 RXRA (0.40) RXRARARGRARARARBRXRB
SCHEMBL6281288 0.81 RXRA (0.31) RXRA
SCHEMBL6283134 0.81 HNF4A (0.40) RXRARARGRARARARBRXRB

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 RXRA 19/4885RARG 144/4885RARA 47/4885

“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.