SCHEMBL5360671

SCHEMBL5360671

Cc1occc1C(O)c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXRA P19793 11/20 0.52
RARB P10826 11/20 0.48
RARG P13631 11/20 0.48
RARA P10276 10/20 0.48
RXRB P28702 5/20 0.43
CYP26A1 O43174 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP26B1 Q9NR63 1/20 0.40
RXRG P48443 3/20 0.35

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
SCHEMBL5359871 0.76 RXRA (0.50) RXRARARBRARGRARARXRB
SCHEMBL10459323 0.74 RXRA (0.51) RXRARARBRARGRARARXRB
SCHEMBL10459874 0.73 RXRA (0.64) RXRARARBRARGRARARXRB
SCHEMBL10458056 0.73 RXRA (0.56) RXRARARBRARGRARARXRB
SCHEMBL3541162 0.72 RXRA (0.58) RXRARARBRARGRARARXRB
SCHEMBL8458824 0.69 RXRA (1.00) RXRARARBRARGRARARXRB
SCHEMBL9097434 0.68 CYP26A1 (0.56) RXRARARBRARGRARARXRB
SCHEMBL3175854 0.68 RXRA (0.57) RXRARARBRARGRARARXRB
SCHEMBL5537842 0.68 RXRA (0.53) RXRARARBRARGRARARXRB
SCHEMBL5357133 0.68 RXRA (0.50) RXRARARBRARGRARARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070099991-A1 SELECTIVE RXR LIGANDS HAFFNER CURT D 2007-05-03 US disclosed
US-7173134-B2 Selective RXR ligands SMITHKLINE BEECHAM CORPORATION (US) 2007-02-06 US disclosed
US-20040198980-A1 Selective rxr ligands SMITHKLINE BEECHAM CORPORATION 2004-10-07 US disclosed
EP-1430042-A2 BICYCLIC HETEROCYCLES AS RXR LIGANDS SmithKline Beecham Corporation (US) 2004-06-23 EP disclosed
WO-2003027090-A2 BICYCLIC HETEROCYCLES AS RXR LIGANDS SMITHKLINE BEECHAM CORPORATION (US) 2003-04-03 WO 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 (2 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-20040198980-A1 Selective rxr ligands RXRA, RXRB, RXRG RXRA 1/4885RARB 19/4885RARG 24/4885
US-20070099991-A1 SELECTIVE RXR LIGANDS RXRB, RXRA, RXRG RXRA 2/4885RARB 14/4885RARG 13/4885

“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.