SCHEMBL9066477

SCHEMBL9066477

CC1CC(C)C(c2ccc(O)cc2)(c2ccc(O)cc2)CC1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 7/20 0.41
ESR1 P03372 5/20 0.41
NPY1R P25929 1/20 0.33
ALOX5AP P20292 1/20 0.32
GAA P10253 2/20 0.31
MAPT P10636 1/20 0.31
XBP1 P17861 1/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
CYP3A4 P08684 1/20 0.30
AR P10275 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
HTR6 P50406 1/20 0.30
ESRRG P62508 1/20 0.30
SLC6A3 Q01959 1/20 0.30
HSD17B10 Q99714 1/20 0.30
CNR2 P34972 1/20 0.30

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
SCHEMBL9065656 0.74 ESR2 (0.45) ESR2ESR1NPY1RALOX5APMAPT
SCHEMBL7803517 0.73 ESR2 (0.44) ESR2ESR1NPY1RALOX5APGAA
SCHEMBL9067002 0.73 ESR2 (0.43) ESR2ESR1NPY1RALOX5APMAPT
SCHEMBL669768 0.70 ESR2 (0.57) ESR2ESR1NPY1RMMP2MMP9
SCHEMBL16581434 0.70 ESR2 (0.53) ESR2ESR1CYP3A4
SCHEMBL12457781 0.70 ESR2 (0.43) ESR2ESR1NPY1RMAPTMMP2
SCHEMBL9065940 0.69 ESR2 (0.37) ESR2ESR1NPY1RCYP3A4AR
SCHEMBL9074169 0.68 ESR2 (0.34) ESR2ESR1ALOX5APGAAMAPT
SCHEMBL19494320 0.67 ESR2 (0.44) ESR2ESR1ALOX5AP
SCHEMBL9066127 0.67 ESR2 (0.40) ESR2ESR1GAAKMT2A

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