SCHEMBL9066385

SCHEMBL9066385

Cc1cc(C2(c3cc(C)c(O)c(C)c3)CCC(C)C(C)C2)cc(C)c1O

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.53
ESR1 P03372 2/20 0.35
ESR2 Q92731 2/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
OPRK1 P41145 1/20 0.31
PTGS1 P23219 1/20 0.30
PTGS2 P35354 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
SCHEMBL9065938 0.81 ALDH1A1 (0.37) ACHEOPRM1OPRD1OPRK1
SCHEMBL9066070 0.81 TSHR (0.33) ACHEOPRM1OPRD1OPRK1
SCHEMBL6857583 0.80 ACHE (0.63) ACHEESR1ESR2CA1CA2
SCHEMBL5388017 0.78 ACHE (0.66) ACHEESR1ESR2CA1CA2
SCHEMBL9066672 0.78 ACHE (0.61) ACHEESR1ESR2CA1CA2
SCHEMBL9315104 0.76 ACHE (0.49) ACHEESR1ESR2CA1CA2
SCHEMBL2044939 0.75 ESR2 (0.49) ESR1ESR2OPRM1OPRD1OPRK1
SCHEMBL675031 0.75 ACHE (0.79) ACHEESR1ESR2CA1CA2
SCHEMBL17636591 0.74 ACHE (0.59) ACHEESR1ESR2CA1CA2
SCHEMBL28309510 0.74 ACHE (0.59) ACHEESR1ESR2CA1CA2

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 9 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
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-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