SCHEMBL8529655

SCHEMBL8529655

[CH2]Cc1cc2c(cc1C)C(C)(C)CCC2(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 15/20 0.49
RXRB P28702 5/20 0.41
RXRG P48443 5/20 0.41
RARA P10276 2/20 0.41
RARB P10826 2/20 0.41
RARG P13631 2/20 0.41
MEN1 O00255 1/20 0.41
CYP26A1 O43174 1/20 0.41
ABCB11 O95342 1/20 0.41
ESR1 P03372 1/20 0.41
PGR P06401 1/20 0.41
HTR1A P08908 1/20 0.41
ADRA2A P08913 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
CHRM1 P11229 1/20 0.41
DRD1 P21728 1/20 0.41
TBXA2R P21731 1/20 0.41
SLC6A2 P23975 1/20 0.41
ADRA1A P35348 1/20 0.41
OPRM1 P35372 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
SCHEMBL22001266 0.82 RXRA (0.54) RXRARXRBRXRGRARARARB
SCHEMBL7931914 0.80 RXRA (0.49) RXRARXRBRXRGRARARARB
SCHEMBL7622765 0.78 RXRA (0.48) RXRARXRBRXRGRARARARB
SCHEMBL9124020 0.77 RXRA (0.50) RXRARXRBRXRGRARARARB
SCHEMBL9626984 0.77 RXRA (0.47) RXRARXRBRXRGRARARARB
SCHEMBL8328559 0.73 RXRA (0.47) RXRARXRBRXRGRARARARB
SCHEMBL14068113 0.71 RXRA (0.66) RXRARXRBRXRGGNRHR
SCHEMBL13843156 0.71 RXRA (0.66) RXRARXRBRXRGGNRHR
SCHEMBL16731567 0.70 RXRA (0.40) RXRARXRBRXRGRARARARB
SCHEMBL5040244 0.70 GNRHR (0.57) RXRAGNRHR

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-0915823-A1 BI-AROMATIC COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME AND USES CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA - CIRD GALDERMA (FR) 1999-05-19 EP disclosed
WO-1998022423-A1 BI-AROMATIC COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME AND USES CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1998-05-28 WO disclosed