SCHEMBL6283142

SCHEMBL6283142

CCC1=CC(C)(C)Oc2cc(OC)c(/C(C)=C\C=C\C(C)=C\C(=O)O)cc21

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RXRA P19793 19/20 0.55
RARG P13631 15/20 0.55
RARA P10276 5/20 0.55
RARB P10826 5/20 0.55
RXRB P28702 5/20 0.55
RXRG P48443 5/20 0.55
PPARG P37231 13/20 0.43
ABCC4 O15439 1/20 0.38
NR1I2 O75469 1/20 0.38
ABCB11 O95342 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL6283378 0.92 RXRA (0.60) RXRARARGRARARARBRXRB
SCHEMBL6300016 0.90 RXRA (0.43) RXRARARGRARARARBRXRB
SCHEMBL6281391 0.85 RXRA (0.55) RXRARARGRARARARBRXRB
SCHEMBL6275730 0.84 RXRA (0.39) RXRARARGRARARARBRXRB
SCHEMBL6304407 0.83 RXRA (0.48) RXRARARGRARARARBRXRB
SCHEMBL6279946 0.79 CYP3A4 (0.36) ALDH1A1
SCHEMBL6275501 0.79 RXRA (0.58) RXRARARGRARARARBRXRB
SCHEMBL6278794 0.78 RXRA (0.43) RXRARARGRARARARBRXRB
SCHEMBL6295681 0.78 RXRA (0.42) RXRARARGRARARARBRXRB
SCHEMBL6279243 0.78 ODC1 (0.30)

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.