SCHEMBL9066657

SCHEMBL9066657

CC(C)C1CCCCC1C1CCCC(c2ccc(O)cc2)(c2ccc(O)cc2)C1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 5/20 0.42
ESR1 P03372 3/20 0.42
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35
HSD11B1 P28845 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
SCHEMBL9074535 0.85 ESR2 (0.46) ESR2ESR1OPRM1OPRD1OPRK1
SCHEMBL9066659 0.78 ESR2 (0.45) ESR2ESR1OPRM1OPRD1OPRK1
SCHEMBL9065902 0.78 ESR2 (0.58) ESR2ESR1OPRM1HSD11B1
SCHEMBL9074035 0.76 ESR2 (0.52) ESR2ESR1OPRM1OPRD1OPRK1
SCHEMBL9074493 0.74 ESR2 (0.32) ESR2ESR1
SCHEMBL13379646 0.74 ESR2 (0.52) ESR2ESR1OPRM1OPRD1OPRK1
SCHEMBL11052718 0.74 ESR2 (0.52) ESR2ESR1OPRM1OPRD1OPRK1
SCHEMBL9615127 0.72 ESR2 (0.43) ESR2ESR1OPRM1OPRD1OPRK1
SCHEMBL935956 0.70 ESR2 (0.57) ESR2ESR1
SCHEMBL9065989 0.70 ESR2 (0.46) ESR2ESR1OPRM1OPRD1OPRK1

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 3 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-0469404-A2 Polyestercarbonates based on 1,1-bis-(4-hydroxyphenyl)-alkylcycloalkanes and thermoplastic blends thereof BAYER AG (DE) 1992-02-05 EP disclosed