SCHEMBL7561574

SCHEMBL7561574

CCN(c1ccc(C(=O)O)cc1)c1cc(C)c2c(c1)C(C)(C)CO2

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 17/20 0.60
RXRB P28702 15/20 0.60
RXRG P48443 15/20 0.60
SSTR5 P35346 1/20 0.44
RARA P10276 2/20 0.41
RARB P10826 2/20 0.41
RARG P13631 2/20 0.41
ALOX5 P09917 1/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41

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
SCHEMBL7570006 0.88 RXRA (0.60) RXRARXRBRXRGRARARARB
SCHEMBL7564506 0.88 RXRA (0.46) RXRARXRBRXRGRARARARB
SCHEMBL7569163 0.85 RXRA (0.57) RXRARXRBRXRGALOX5PTGS1
SCHEMBL8120734 0.85 RXRA (0.57) RXRARXRBRXRGRARARARB
SCHEMBL8121956 0.84 RXRA (0.54) RXRARXRBRXRGSSTR5RARA
SCHEMBL8110045 0.81 RXRA (0.43) RXRARXRBRXRGSSTR5RARA
SCHEMBL8117493 0.78 RXRA (0.56) RXRARXRBRXRGALOX5PTGS1
SCHEMBL8123033 0.78 RXRA (0.56) RXRARXRBRXRGSSTR5RARA
SCHEMBL8117130 0.78 RXRA (0.45) RXRARXRBRXRGRARARARB
SCHEMBL20411352 0.78 RXRA (0.72) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1228055-A1 DIHYDROAMINOBENZO[B]- AND [C]FURANS AS RETINOID-LIKE AGENTS Allergan Sales, Inc. (US) 2002-08-07 EP disclosed
WO-2001012618-A1 DIHYDROAMINOBENZO[B]- AND [C]FURANS AS RETINOID-LIKE AGENTS ALLERGAN SALES, INC. (US) 2001-02-22 WO disclosed
US-6093838-A FOR TREATING SKIN-RELATED DISEASES, INCLUDING ACTINIC KERATOSES, ARSENIC KERATOSES, ECZEMA ALLERGAN SALES, INC. (US) 2000-07-25 US disclosed