SCHEMBL7756259

SCHEMBL7756259

Cc1cc2c(cc1C13CCC(=CCc4ccc(C(=O)OC(=O)c5ccc(CC=C6CCC7(c8ccc9c(c8)C(C)(C)CCC9(C)C)CC67)nc5)cn4)C1C3)C(C)(C)CCC2(C)C

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 16/20 0.37
RXRB P28702 9/20 0.37
RXRG P48443 9/20 0.37
RARA P10276 4/20 0.37
RARB P10826 4/20 0.37
RARG P13631 3/20 0.37
PPARG P37231 2/20 0.37
CYP3A4 P08684 2/20 0.34
CYP26A1 O43174 4/20 0.33
CYP26B1 Q9NR63 4/20 0.33

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
SCHEMBL7756272 0.96 RXRA (0.35) RXRARXRBRXRGRARARARB
SCHEMBL7756256 0.92 RXRA (0.46) RXRARXRBRXRGRARARARB
SCHEMBL7756251 0.92 RXRA (0.46) RXRARXRBRXRGRARARARB
SCHEMBL7756267 0.89 RXRA (0.43) RXRARXRBRXRGRARARARB
SCHEMBL7756261 0.89 RXRA (0.43) RXRARXRBRXRGRARARARB
SCHEMBL7789372 0.86 RXRA (0.51) RXRARXRBRXRGRARARARB
SCHEMBL7789369 0.86 RXRA (0.51) RXRARXRBRXRGRARARARB
SCHEMBL7754580 0.86 RXRA (0.46) RXRARXRBRXRGRARARARB
SCHEMBL7754583 0.86 RXRA (0.46) RXRARXRBRXRGRARARARB
SCHEMBL7755025 0.84 RXRA (0.39) RXRARXRBRXRGRARARARB

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 disclosed
WO-1999058486-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1999-11-18 WO disclosed