SCHEMBL9067006

SCHEMBL9067006

CC1CCC(c2cc(Cl)c(O)c(Cl)c2)(c2cc(Cl)c(O)c(Cl)c2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.39
TSHR P16473 2/20 0.37
HSD17B10 Q99714 2/20 0.37
TTR P02766 2/20 0.37
ALDH1A1 P00352 2/20 0.37
RECQL P46063 2/20 0.37
CYP3A4 P08684 1/20 0.37
ESR2 Q92731 2/20 0.36
THRB P10828 1/20 0.34
CYP2C9 P11712 2/20 0.33
CYP1A2 P05177 1/20 0.33
ALOX15 P16050 1/20 0.33
ALOX12 P18054 1/20 0.33
CYP2C19 P33261 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HIF1A Q16665 1/20 0.33
CYP2D6 P10635 1/20 0.33
SLC6A3 Q01959 6/20 0.32
SLC6A4 P31645 5/20 0.32
L3MBTL1 Q9Y468 2/20 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
SCHEMBL9066311 0.81 ESR2 (0.45) TSHRHSD17B10ESR2SLC6A3SLC6A4
SCHEMBL17636605 0.81 ACHE (0.36) ACHETSHRHSD17B10TTRALDH1A1
SCHEMBL9073978 0.81 ACHE (0.36) ACHETSHRHSD17B10TTRALDH1A1
SCHEMBL9066070 0.81 TSHR (0.33) ACHETSHRHSD17B10TTRALDH1A1
SCHEMBL9066691 0.81 ACHE (0.36) ACHETSHRHSD17B10TTRALDH1A1
SCHEMBL9065627 0.80 HSD11B1 (0.42) ESR2SMN1; SMN2MEN1ESR1GAA
SCHEMBL9066478 0.80 ACHE (0.39) ACHETSHRCYP2C9CYP2D6SLC6A3
SCHEMBL6857583 0.79 ACHE (0.63) ACHEESR2THRBCYP2C9ESR1
SCHEMBL9066563 0.79 TSHR (0.41) ACHETSHRHSD17B10TTRALDH1A1
SCHEMBL4245311 0.78 ACHE (0.55) ACHETSHRHSD17B10TTRALDH1A1

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 5 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
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
EP-0413190-A2 Polycarbonates prepared from n-alkyl substituted cyclohexylidene diphenols BAYER AG (DE) 1991-02-20 EP disclosed