SCHEMBL9066478

SCHEMBL9066478

CC1CCCC(c2cc(Cl)c(O)c(Cl)c2)(c2cc(Cl)c(O)c(Cl)c2)C1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.39
SLC6A3 Q01959 6/20 0.35
SLC6A4 P31645 4/20 0.35
SLC6A2 P23975 1/20 0.35
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL9066364 0.83 ESR1 (0.44) SLC6A3SLC6A4SLC6A2CYP2D6CYP2C9
SCHEMBL9066672 0.82 ACHE (0.61) ACHE
SCHEMBL9066255 0.81 ALDH1A1 (0.39) ACHECYP2D6CYP2C9TSHR
SCHEMBL9074141 0.80 ACHE (0.36) ACHESLC6A3SLC6A4SLC6A2CYP2D6
SCHEMBL9066123 0.80 ACHE (0.36) ACHESLC6A3SLC6A4SLC6A2CYP2D6
SCHEMBL9065500 0.80 HSD17B10 (0.37) ACHECYP2D6CYP2C9TSHR
SCHEMBL9067006 0.80 ACHE (0.39) ACHESLC6A3SLC6A4CYP2D6CYP2C9
SCHEMBL9066070 0.79 TSHR (0.33) ACHESLC6A3SLC6A4SLC6A2CYP2D6
SCHEMBL9066246 0.78 CYP1A2 (0.37) ACHECYP2C9
SCHEMBL4245311 0.77 ACHE (0.55) ACHESLC6A3SLC6A4SLC6A2CYP2D6

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