SCHEMBL4258864

SCHEMBL4258864

CC(C)(C)C(=Cc1ccc(C(=C2CCCCC2)c2ccc(O)cc2)c(F)c1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 6/20 0.40
ESR2 Q92731 5/20 0.40
PGR P06401 1/20 0.33
CHRM2 P08172 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
AR P10275 1/20 0.33
CHRM1 P11229 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A3 Q01959 1/20 0.33
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
RXRG P48443 1/20 0.31
PTGS2 P35354 1/20 0.31
OPRM1 P35372 1/20 0.30
OPRD1 P41143 1/20 0.30
EPHX2 P34913 1/20 0.30
NR1H4 Q96RI1 1/20 0.30
ESRRG P62508 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL4257511 0.88 ESR1 (0.40) ESR1ESR2PGRCHRM2ADORA3
SCHEMBL4258955 0.85 ESR1 (0.50) ESR1ESR2PGRCHRM2ADORA3
SCHEMBL4257439 0.85 ESR1 (0.50) ESR1ESR2PGRCHRM2ADORA3
SCHEMBL4259426 0.84 ESR1 (0.48) ESR1ESR2PGRCHRM2ADORA3
SCHEMBL4254777 0.81 SNCA (0.39) ESR1ESR2PGRCHRM2ADORA3
SCHEMBL4256100 0.81 ESR1 (0.39) ESR1ESR2PGRCHRM2ADORA3
SCHEMBL4258861 0.80 ESR1 (0.38) ESR1ESR2PGRCHRM2ADORA3
SCHEMBL3468567 0.79 ESR1 (0.52) ESR1ESR2PGRMEN1ALDH1A1
SCHEMBL3468566 0.79 ESR1 (0.52) ESR1ESR2PGRMEN1ALDH1A1
SCHEMBL3468226 0.79 ESR1 (0.52) ESR1ESR2PGRMEN1ALDH1A1

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 2/4885PGR 10/4885

“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.