SCHEMBL5356750

SCHEMBL5356750

CC1(C)CCC(C)(C)c2cc(C3CCCc4oc(/C=C/C(=O)O)cc43)ccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RXRA P19793 16/20 1.00
RARA P10276 2/20 0.50
RARB P10826 2/20 0.46
RARG P13631 2/20 0.46
CYP26A1 O43174 2/20 0.45
CYP3A4 P08684 1/20 0.44
CYP26B1 Q9NR63 1/20 0.42

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
SCHEMBL5356754 1.00 RXRA (1.00) RXRARARARARBRARGCYP26A1
SCHEMBL14212730 1.00 RXRA (1.00) RXRARARARARBRARGCYP26A1
SCHEMBL29503658 1.00 RXRA (1.00) RXRARARARARBRARGCYP26A1
SCHEMBL5361615 0.85 RXRA (0.74) RXRARARARARBRARG
SCHEMBL5356973 0.85 RXRA (1.00) RXRARARARARBRARGCYP26A1
SCHEMBL5356964 0.85 RXRA (1.00) RXRARARARARBRARGCYP26A1
SCHEMBL13752411 0.83 RXRA (0.72) RXRARARARARBRARGCYP26A1
SCHEMBL5361755 0.82 RXRA (1.00) RXRARARARARBRARGCYP26A1
SCHEMBL5359410 0.82 RXRA (1.00) RXRARARARARBRARGCYP26A1
SCHEMBL5361764 0.82 RXRA (1.00) RXRARARARARBRARGCYP26A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7173134-B2 Selective RXR ligands SMITHKLINE BEECHAM CORPORATION (US) 2007-02-06 US claimed
US-10328040-B2 Therapeutic methods ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2019-06-25 US disclosed
US-20160338981-A1 THERAPEUTIC METHODS ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2016-11-24 US disclosed
US-20160338981-A1 THERAPEUTIC METHODS ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2016-11-24 US disclosed
WO-2015109318-A2 THERAPEUTIC METHODS ARIZONA BOARD OF REGENTS, A BODY CORPORATE OF THE STATE OF ARIZONA, ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2015-07-23 WO disclosed
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 (4 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 1/4885RARA 18/4885RARB 19/4885
US-20070099991-A1 SELECTIVE RXR LIGANDS RXRB, RXRA, RXRG RXRA 2/4885RARA 17/4885RARB 14/4885
US-20160338981-A1 THERAPEUTIC METHODS RXRG, RXRB, RXRA RXRA 3/4885RARA 20/4885RARB 5/4885
US-10328040-B2 Therapeutic methods RXRG, RXRB, RXRA RXRA 3/4885RARA 20/4885RARB 5/4885

“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.