SCHEMBL4254777

SCHEMBL4254777

CC(C)(C)C(=Cc1ccc(C(=C2CCCCC2)c2ccc(O)c(F)c2)cc1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.39
ESR1 P03372 7/20 0.37
ESR2 Q92731 6/20 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
RARB P10826 3/20 0.35
RARA P10276 2/20 0.35
RARG P13631 2/20 0.35
ESRRG P62508 1/20 0.34
P4HB P07237 2/20 0.34
ACHE P22303 1/20 0.34
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MIF P14174 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
SCHEMBL4257439 0.85 ESR1 (0.50) ESR1ESR2PGRCHRM2ADORA3
SCHEMBL4258955 0.85 ESR1 (0.50) ESR1ESR2PGRCHRM2ADORA3
SCHEMBL4259426 0.84 ESR1 (0.48) ESR1ESR2PGRCHRM2ADORA3
SCHEMBL4262523 0.83 ESR1 (0.40) ESR1ESR2PGRCHRM2ADORA3
SCHEMBL4256100 0.83 ESR1 (0.39) ESR1ESR2PGRCHRM2ADORA3
SCHEMBL4253238 0.83 ESR1 (0.39) SNCAESR1ESR2PGRCHRM2
SCHEMBL4254771 0.81 ESR1 (0.39) SNCAESR1ESR2PGRCHRM2
SCHEMBL4258864 0.81 ESR1 (0.40) ESR1ESR2PGRCHRM2ADORA3
SCHEMBL3468533 0.78 KDM4E (0.54) SNCAESR1ESR2PGRCHRM2
SCHEMBL3468123 0.78 SNCA (0.56) SNCAESR1ESR2RARBP4HB

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 SNCA 4701/4885ESR1 3/4885ESR2 2/4885

“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.