SCHEMBL9050845

SCHEMBL9050845

CC1(C)CCC(C)(C)c2cc3c(CO)cc(-c4ccc(C(=O)O)cc4)cc3cc21

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RARB P10826 12/20 0.64
RARG P13631 12/20 0.64
RARA P10276 10/20 0.64
RXRA P19793 10/20 0.52
RXRB P28702 3/20 0.51
RXRG P48443 3/20 0.51

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
SCHEMBL9051350 0.91 RARB (0.62) RARBRARGRARARXRARXRB
SCHEMBL9048887 0.87 RARB (0.60) RARBRARGRARARXRARXRB
SCHEMBL9050841 0.87 RARB (0.60) RARBRARGRARARXRARXRB
SCHEMBL9049309 0.85 RARB (0.52) RARBRARGRARARXRA
SCHEMBL9050626 0.84 RARB (0.69) RARBRARGRARARXRARXRB
SCHEMBL9054209 0.84 RARG (0.69) RARBRARGRARARXRARXRB
SCHEMBL9049761 0.84 RARB (0.69) RARBRARGRARARXRARXRB
Hydrochloric Acid SCHEMBL9050569 0.83 RARB (0.56) RARBRARGRARARXRARXRB
SCHEMBL4192048 0.82 RARB (0.67) RARBRARGRARARXRARXRB
SCHEMBL9049859 0.81 RARB (0.66) RARBRARGRARARXRARXRB

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
WO-1995033745-A9 NOVEL COMPOUNDS USEFUL IN MODULATING GENE EXPRESSION OF RETINOID RESPONSIVE GENES AND/OR HAVING ANTI-AP-1 ACTIVITY 1996-01-18 WO disclosed
WO-1995033745-A2 NOVEL COMPOUNDS USEFUL IN MODULATING GENE EXPRESSION OF RETINOID RESPONSIVE GENES AND/OR HAVING ANTI-AP-1 ACTIVITY SRI INTERNATIONAL (US) 1995-12-14 WO disclosed