SCHEMBL7756261

SCHEMBL7756261

CC1(C)CCC(C)(C)c2cc(C34CC/C(=C/Cc5ccc(C(=O)O)cc5)C3C4)ccc21.Cc1cc2c(cc1C13CC/C(=C/Cc4ccc(C(=O)O)cn4)C1C3)C(C)(C)CCC2(C)C

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RXRA P19793 17/20 0.43
RXRB P28702 9/20 0.43
RXRG P48443 8/20 0.43
RARB P10826 5/20 0.43
RARG P13631 5/20 0.43
RARA P10276 4/20 0.43
PPARG P37231 1/20 0.43
CYP26A1 O43174 4/20 0.39
CYP26B1 Q9NR63 3/20 0.39
CYP3A4 P08684 2/20 0.37
CRABP2 P29373 1/20 0.37

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
SCHEMBL7756267 1.00 RXRA (0.43) RXRARXRBRXRGRARBRARG
SCHEMBL7756251 0.96 RXRA (0.46) RXRARXRBRXRGRARBRARG
SCHEMBL7756256 0.96 RXRA (0.46) RXRARXRBRXRGRARBRARG
SCHEMBL7756272 0.91 RXRA (0.35) RXRARXRBRXRGRARBRARG
SCHEMBL7789372 0.91 RXRA (0.51) RXRARXRBRXRGRARBRARG
SCHEMBL7789369 0.91 RXRA (0.51) RXRARXRBRXRGRARBRARG
SCHEMBL7754583 0.91 RXRA (0.46) RXRARXRBRXRGRARBRARG
SCHEMBL7754580 0.91 RXRA (0.46) RXRARXRBRXRGRARBRARG
SCHEMBL7756259 0.89 RXRA (0.37) RXRARXRBRXRGRARBRARG
SCHEMBL7757722 0.86 RXRA (0.51) RXRARXRBRXRGRARBRARG

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-1077919-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2001-02-28 EP claimed
WO-1999058486-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1999-11-18 WO claimed