SCHEMBL8445688

SCHEMBL8445688

CCCCCNc1c2c(cc3c1C(C)(C)CCC3(C)C)C(=CC=CC(C)=CC(=O)O)CCC2

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RXRA P19793 20/20 0.42
RXRG P48443 14/20 0.39
RXRB P28702 13/20 0.39
RARG P13631 6/20 0.39
RARB P10826 5/20 0.39
RARA P10276 3/20 0.39

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
SCHEMBL8445684 1.00 RXRA (0.42) RXRARXRGRXRBRARGRARB
SCHEMBL8309025 0.85 RXRA (0.46) RXRARXRGRXRBRARGRARB
SCHEMBL8309023 0.85 RXRA (0.46) RXRARXRGRXRBRARGRARB
SCHEMBL8313527 0.77 RXRA (0.37) RXRARXRGRXRBRARGRARB
SCHEMBL8311522 0.77 RXRA (0.46) RXRARXRGRXRBRARGRARB
SCHEMBL8311020 0.77 RXRA (0.46) RXRARXRGRXRBRARGRARB
SCHEMBL8309720 0.77 RXRA (0.46) RXRARXRGRXRBRARGRARB
SCHEMBL8311518 0.77 RXRA (0.46) RXRARXRGRXRBRARGRARB
SCHEMBL8309727 0.77 RXRA (0.46) RXRARXRGRXRBRARGRARB
SCHEMBL8309723 0.77 RXRA (0.46) RXRARXRGRXRBRARGRARB

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
EP-0933350-A1 Tricyclic retinoids, methods for their production and use LIGAND PHARMACEUTICALS INCORPORATED (US) 1999-08-04 EP disclosed
EP-0933351-A1 Tricyclic retinoids, methods for their production and use LIGAND PHARMACEUTICALS INCORPORATED (US) 1999-08-04 EP disclosed
EP-0800504-A1 TRICYCLIC RETINOIDS, METHODS FOR THEIR PRODUCTION AND USE LIGAND PHARMACEUTICALS, INC. (US) 1997-10-15 EP disclosed
WO-1996020914-A1 TRICYCLIC RETINOIDS, METHODS FOR THEIR PRODUCTION AND USE LIGAND PHARMACEUTICALS INCORPORATED (US) 1996-07-11 WO disclosed