SCHEMBL9065656

SCHEMBL9065656

CC1CCC(C)C(c2ccc(O)cc2)(c2ccc(O)cc2)C1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 8/20 0.45
ESR1 P03372 4/20 0.45
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
CYP2C19 P33261 1/20 0.35
RECQL P46063 1/20 0.35
NPY1R P25929 1/20 0.33
ALOX5AP P20292 1/20 0.32
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31

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
SCHEMBL16581434 0.81 ESR2 (0.53) ESR2ESR1CYP2C9
SCHEMBL9065940 0.80 ESR2 (0.37) ESR2ESR1ALDH1A1HPGDNPY1R
SCHEMBL9066477 0.74 ESR2 (0.41) ESR2ESR1MAPTHPGDNPY1R
SCHEMBL1501263 0.74 ESR2 (0.48) ESR2ESR1MAPT
SCHEMBL9067002 0.73 ESR2 (0.43) ESR2ESR1ALDH1A1CYP1A2MAPT
SCHEMBL30132903 0.73 ESR2 (0.50) ESR2ESR1MAPT
SCHEMBL7803517 0.73 ESR2 (0.44) ESR2ESR1ALDH1A1CYP1A2MAPT
SCHEMBL8776956 0.71 ESR2 (0.46) ESR2ESR1MAPTMMP2MMP9
SCHEMBL9612266 0.71 ESR2 (0.40) ESR2ESR1ALDH1A1CYP1A2MAPT
SCHEMBL10899121 0.71 ESR2 (0.44) ESR2ESR1ALDH1A1CYP1A2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0469403-B1 High molecular weight polyester based on 1,1-bis-(4-hydroxyphenyl)-alkylcycloalkanes and thermoplastic blends thereof BAYER AG (DE) 1996-02-28 EP disclosed
EP-0469404-B1 Polyestercarbonates based on 1,1-bis-(4-hydroxyphenyl)-alkylcycloalkanes and thermoplastic blends thereof BAYER AG (DE) 1996-02-28 EP disclosed
EP-0414053-B1 POLYCARBONATES FROM SUBSTITUTED CYCLOHEXYLIDENE DIPHENOLS BAYER AG (DE) 1992-10-28 EP disclosed
EP-0469404-A2 Polyestercarbonates based on 1,1-bis-(4-hydroxyphenyl)-alkylcycloalkanes and thermoplastic blends thereof BAYER AG (DE) 1992-02-05 EP disclosed
EP-0469403-A2 High molecular weight polyester based on 1,1-bis-(4-hydroxyphenyl)-alkylcycloalkanes and thermoplastic blends thereof BAYER AG (DE) 1992-02-05 EP disclosed
US-5034458-A Polycarbonate for use in molding materials for laminated films and for electronics BAYER AKTIENGESELLSCHAFT (DE) 1991-07-23 US disclosed
EP-0414053-A2 Polycarbonates from substituted cyclohexylidene diphenols BAYER AG (DE) 1991-02-27 EP disclosed