SCHEMBL11907576

SCHEMBL11907576

Cc1cc(C(C)(CC(c2cc(C)c(O)c(C)c2)c2cc(C)c(O)c(C)c2)c2ccc(O)c(C)c2)ccc1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 17/20 0.49
ESR2 Q92731 8/20 0.46
AR P10275 3/20 0.46
VDR P11473 1/20 0.37
CHEK1 O14757 1/20 0.36
FYN P06241 1/20 0.36
PDGFRB P09619 1/20 0.36
PIM1 P11309 1/20 0.36
FGFR1 P11362 1/20 0.36
FLT1 P17948 1/20 0.36
GRK5 P34947 1/20 0.36
MAP2K2 P36507 1/20 0.36
MAPK8 P45983 1/20 0.36
CDK8 P49336 1/20 0.36
RPS6KA3 P51812 1/20 0.36
PRKX P51817 1/20 0.36
JAK3 P52333 1/20 0.36
LIMK1 P53667 1/20 0.36
BTK Q06187 1/20 0.36
TYRO3 Q06418 1/20 0.36

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
SCHEMBL8908701 0.87 ESR1 (0.44) ESR1ESR2TP53
SCHEMBL5617933 0.84 ESR1 (0.53) ESR1ESR2AR
SCHEMBL23140662 0.83 ESR1 (0.51) ESR1ESR2AR
SCHEMBL30708954 0.78 ESR1 (0.57) ESR1ESR2ARTP53TDP1
SCHEMBL31666450 0.78 ESR1 (0.57) ESR1ESR2ARTP53TDP1
SCHEMBL311579 0.78 ESR1 (0.57) ESR1ESR2ARTP53TDP1
SCHEMBL5873699 0.78 ESR1 (0.57) ESR1ESR2ARCHEK1FYN
SCHEMBL8459895 0.78 ESR1 (0.39) ESR1ESR2ARTDP1
SCHEMBL8735289 0.77 ESR1 (0.61) ESR1ESR2ARVDR
SCHEMBL17803638 0.75 ESR1 (0.42) ESR1ESR2ARTP53TDP1

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-20120208936-A1 POLYCARBONATE COMPOSITIONS WITH IMPROVED MELT STABILITY BAYER MATERIALSCIENCE AG (DE) 2012-08-16 US disclosed