SCHEMBL9065989

SCHEMBL9065989

CC1CC(c2ccc(O)cc2)(c2ccc(O)cc2)CCC1C1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 7/20 0.46
ESR1 P03372 4/20 0.46
OPRM1 P35372 3/20 0.34
OPRD1 P41143 2/20 0.33
OPRK1 P41145 2/20 0.33
OPRL1 P41146 1/20 0.32
GRIN2B Q13224 2/20 0.32
KMT2A Q03164 2/20 0.31
GAA P10253 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
SCHEMBL9615127 0.82 ESR2 (0.43) ESR2ESR1OPRM1OPRD1OPRK1
SCHEMBL16581573 0.81 ESR2 (0.45) ESR2ESR1
SCHEMBL2044939 0.79 ESR2 (0.49) ESR2ESR1OPRM1OPRD1OPRK1
SCHEMBL13379646 0.78 ESR2 (0.52) ESR2ESR1OPRM1OPRD1OPRK1
SCHEMBL11052718 0.78 ESR2 (0.52) ESR2ESR1OPRM1OPRD1OPRK1
SCHEMBL9065421 0.77 ESR2 (0.64) ESR2ESR1OPRM1KMT2A
SCHEMBL9065902 0.76 ESR2 (0.58) ESR2ESR1OPRM1GRIN2BKMT2A
SCHEMBL10436113 0.76 ESR2 (0.53) ESR2ESR1OPRM1KMT2AGAA
SCHEMBL3302933 0.73 ESR2 (0.69) ESR2ESR1OPRM1KMT2A
SCHEMBL26690449 0.73 ESR2 (0.58) ESR2ESR1

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 8 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-0374623-B1 POLYCARBONATES FROM POLYSUBSTITUTED CYCLOHEXYLIDENE DIPHENOLS BAYER AG (DE) 1992-05-27 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
US-5034457-A Polycarbonate for use in molding materials for laminated films and for electronics BAYER AKTIENGESELLSCHAFT (DE) 1991-07-23 US disclosed
US-5021542-A Molding materials BAYER AKTIENGESELLSCHAFT (DE) 1991-06-04 US disclosed
EP-0387593-A2 Thermoplastic alloys of polycarbonates based on substituted cyclohexylidenbisphenols BAYER AG (DE) 1990-09-19 EP disclosed
EP-0374623-A2 Polycarbonates from polysubstituted cyclohexylidene diphenols BAYER AG (DE) 1990-06-27 EP disclosed