SCHEMBL7757702

SCHEMBL7757702

COC1(c2ccc(C(=O)O)c(C3(OC)CCCC3c3cc4c(cc3C)C(C)(C)CCC4(C)C)c2)CCCC1c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RXRA P19793 18/20 0.45
RARG P13631 5/20 0.45
RARB P10826 4/20 0.45
RXRB P28702 4/20 0.35
RXRG P48443 4/20 0.35
CYP26A1 O43174 2/20 0.35
CYP26B1 Q9NR63 2/20 0.35
RARA P10276 2/20 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
SCHEMBL7754550 0.81 RXRA (0.52) RXRARARGRARBRXRBRXRG
SCHEMBL7756268 0.80 RXRA (0.52) RXRARARGRARBRXRBRXRG
SCHEMBL7755783 0.75 RXRA (0.55) RXRARARGRARBRXRBRXRG
SCHEMBL7755781 0.75 RXRA (0.55) RXRARARGRARBRXRBRXRG
SCHEMBL7755796 0.75 RXRA (0.55) RXRARARGRARBRXRBRXRG
SCHEMBL7757741 0.74 RARG (0.36) RXRARARGRARBRXRBRXRG
SCHEMBL7788780 0.72 RXRA (0.56) RXRARARGRARBRXRBRXRG
SCHEMBL7756218 0.70 RXRA (0.49) RXRARARGRARBRXRBRXRG
SCHEMBL7755791 0.70 RXRA (0.49) RXRARARGRARBRXRBRXRG
SCHEMBL7755808 0.67 RXRA (0.47) RXRARARGRARBRXRBRXRG

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
EP-1077920-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2001-02-28 EP disclosed
WO-1999058487-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1999-11-18 WO disclosed