SCHEMBL4254768

SCHEMBL4254768

CC/C(=C\C(=O)O)c1ccc(C(=C2CCCCC2)c2ccc(O)cc2C)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.39
ESR2 Q92731 6/20 0.39
HSP90AB1 P08238 1/20 0.37
PGR P06401 1/20 0.36
CHRM2 P08172 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
AR P10275 1/20 0.36
CHRM1 P11229 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A3 Q01959 1/20 0.36
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA7 P43166 2/20 0.35
CA9 Q16790 2/20 0.35
CA14 Q9ULX7 2/20 0.35
RXRA P19793 4/20 0.34
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL4257989 0.90 ESR1 (0.37) ESR1ESR2HSP90AB1PGRCHRM2
SCHEMBL4261805 0.86 ESR1 (0.36) ESR1ESR2PGRCHRM2ADORA3
SCHEMBL4258000 0.83 ESR1 (0.40) ESR1ESR2PGRCHRM2ADORA3
SCHEMBL4258689 0.83 ESR1 (0.35) ESR1ESR2PGRCHRM2ADORA3
SCHEMBL4254775 0.80 ESR1 (0.42) ESR1ESR2HSP90AB1PGRCHRM2
SCHEMBL4253232 0.79 ESR1 (0.39) ESR1ESR2PGRCHRM2ADORA3
SCHEMBL4255125 0.79 HSP90AA1 (0.41) ESR1ESR2HSP90AB1PGRCHRM2
SCHEMBL4257160 0.79 HSP90AA1 (0.41) ESR1ESR2HSP90AB1PGRCHRM2
SCHEMBL3467632 0.79 ESR1 (0.54) ESR1ESR2PGRCA12CA1
SCHEMBL3467630 0.79 ESR1 (0.54) ESR1ESR2PGRCA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7569601-B2 Cycloalkylidene compounds as modulators of estrogen receptor SMITHKLINE BEECHAM CORPORATION (US) 2009-08-04 US disclosed
US-20070213348-A1 Chemical Compounds BRITTON JONATHAN E 2007-09-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070213348-A1 Chemical Compounds GPER1, ESR2, ESR1 ESR1 3/4885ESR2 2/4885HSP90AB1 1255/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.