SCHEMBL6917353

SCHEMBL6917353

COC(=O)c1ccc(C(=O)C2=CCCc3cc4c(cc32)C(C)(C)CCC4(C)C)cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.46
CYP26A1 O43174 2/20 0.43
RXRA P19793 12/20 0.41
RARB P10826 5/20 0.40
RARG P13631 5/20 0.40
RXRB P28702 3/20 0.40
RXRG P48443 3/20 0.40
RARA P10276 4/20 0.39
HNF4A P41235 2/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36

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
SCHEMBL6915745 0.80 RXRA (0.45) CYP3A4CYP26A1RXRARARBRARG
SCHEMBL7422927 0.74 RXRA (0.70) CYP3A4CYP26A1RXRARARBRARG
SCHEMBL8811420 0.74 CYP3A4 (0.46) CYP3A4CYP26A1RXRARARBRARG
SCHEMBL3982018 0.72 RXRA (0.72) CYP3A4CYP26A1RXRARARBRARG
SCHEMBL6915712 0.71 RXRA (0.72) CYP3A4CYP26A1RXRARARBRARG
SCHEMBL2788640 0.71 CYP3A4 (0.70) CYP3A4CYP26A1RXRARARBRARG
SCHEMBL7622797 0.70 RXRA (0.55) CYP3A4CYP26A1RXRARARBRARG
SCHEMBL6274241 0.70 RXRA (0.53) CYP3A4CYP26A1RXRARARBRARG
SCHEMBL8809523 0.70 CYP3A4 (0.42) CYP3A4CYP26A1RXRARARBRARG
SCHEMBL24055312 0.69 RXRA (0.67) CYP3A4CYP26A1RXRARARBRARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040019072-A1 Dimer-selective RXR modulators and methods for their use CANAN-KOCH STACIE (US) 2004-01-29 US disclosed
EP-1336600-A2 Dimer-selective RXR modulators and methods for their use LIGAND PHARMACEUTICALS INCORPORATED (US) 2003-08-20 EP disclosed
EP-0873295-A1 DIMER-SELECTIVE RXR MODULATORS AND METHODS FOR THEIR USE LIGAND PHARMACEUTICALS, INC. (US) 1998-10-28 EP disclosed
WO-1997012853-A1 DIMER-SELECTIVE RXR MODULATORS AND METHODS FOR THEIR USE LIGAND PHARMACEUTICALS INCORPORATED (US) 1997-04-10 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 (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-20040019072-A1 Dimer-selective RXR modulators and methods for their use RXRG, RXRB, RXRA CYP3A4 514/4885CYP26A1 420/4885RXRA 3/4885

“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.