SCHEMBL13066967

SCHEMBL13066967

CCCC1CCC(C2CCC(COc3ccc(-c4ccc(C(C)O)cc4)c(C(F)F)c3F)CC2)CC1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
VEGFA P15692 1/20 0.36
APP P05067 1/20 0.33
PDE4D Q08499 4/20 0.32
PDE4B Q07343 4/20 0.32
PDE4A P27815 3/20 0.32
PDE4C Q08493 3/20 0.32
ACACB O00763 3/20 0.32
KDM1A O60341 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
SCHEMBL13025994 0.86 VEGFA (0.35) VEGFAPDE4DPDE4BPDE4AACACB
SCHEMBL13066965 0.85 VEGFA (0.39) VEGFAAPPPDE4DPDE4BPDE4A
SCHEMBL13066741 0.83
SCHEMBL13025813 0.83 PDE4D (0.38) VEGFAPDE4DPDE4BPDE4APDE4C
SCHEMBL13067349 0.83 AKR1C3 (0.30)
SCHEMBL13066957 0.80
SCHEMBL13025935 0.79 CYP2C9 (0.37) VEGFAAPPKDM1A
SCHEMBL13025958 0.79 FFAR4 (0.39) VEGFA
SCHEMBL13025861 0.79 VEGFA (0.39) VEGFAPDE4DPDE4BPDE4APDE4C
SCHEMBL13671443 0.79 VEGFA (0.42) VEGFAPDE4DPDE4BPDE4APDE4C

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7838087-B2 Benzene derivative, liquid crystal composition and liquid crystal display device CHISSO CORPORATION (JP) 2010-11-23 US disclosed