SCHEMBL7771303

SCHEMBL7771303

Cc1cc2c(cc1C1(C)COc3cc(OC(=O)O)ccc31)C(C)(C)CCC2(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 18/20 0.45
RXRB P28702 13/20 0.41
RXRG P48443 13/20 0.41
RARG P13631 6/20 0.41
RARB P10826 5/20 0.41
RARA P10276 3/20 0.41
PPARG P37231 2/20 0.38
MEN1 O00255 1/20 0.38
CYP26A1 O43174 1/20 0.38
ABCB11 O95342 1/20 0.38
ESR1 P03372 1/20 0.38
PGR P06401 1/20 0.38
HTR1A P08908 1/20 0.38
ADRA2A P08913 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
CHRM1 P11229 1/20 0.38
DRD1 P21728 1/20 0.38
TBXA2R P21731 1/20 0.38
SLC6A2 P23975 1/20 0.38
ADRA1A P35348 1/20 0.38

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
SCHEMBL7771646 0.89 RXRA (0.41) RXRARXRBRXRGRARGRARB
SCHEMBL7771786 0.85 RXRA (0.44) RXRARXRBRXRGRARGRARB
SCHEMBL6734814 0.83 RXRA (0.58) RXRARXRBRXRGRARGRARB
SCHEMBL6733785 0.81 RXRA (0.46) RXRARXRBRXRGRARGRARB
SCHEMBL9200174 0.77 RXRA (0.50) RXRARXRBRXRGRARGRARB
SCHEMBL7771769 0.77 RXRA (0.44) RXRARXRBRXRGRARGRARB
SCHEMBL7801892 0.76 RXRA (0.58) RXRARXRBRXRGRARGRARB
SCHEMBL7769613 0.74 RXRA (0.40) RXRARXRBRXRGRARGRARB
SCHEMBL8093205 0.74 RARB (0.50) RXRARXRBRXRGRARGRARB
SCHEMBL7773881 0.73 CYP26B1 (0.42) RXRARXRBRXRGRARGRARB

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0823903-B1 HETEROCYCLIC DIARYL COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME, AND USES THEREOF CT INTERNAT DE RECH S (FR) 2001-07-18 EP claimed