SCHEMBL4254770

SCHEMBL4254770

CC(C)(C)OC(=O)/C=C/c1ccc(C(=C2CCCCC2)c2ccc(O)c(F)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.48
ESR1 P03372 6/20 0.45
ESR2 Q92731 4/20 0.45
P4HB P07237 3/20 0.42
NR1H4 Q96RI1 6/20 0.40
PGR P06401 1/20 0.38
CHRM2 P08172 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
AR P10275 1/20 0.38
CHRM1 P11229 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A3 Q01959 1/20 0.38
PTPN1 P18031 1/20 0.37
TTR P02766 1/20 0.36
APP P05067 1/20 0.36
CYP3A4 P08684 1/20 0.35

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
SCHEMBL4254773 1.00 SNCA (0.48) SNCAESR1ESR2P4HBNR1H4
SCHEMBL4258948 0.86 ESR1 (0.60) ESR1ESR2P4HBNR1H4PGR
SCHEMBL4257432 0.86 ESR1 (0.60) ESR1ESR2P4HBNR1H4PGR
SCHEMBL4257437 0.86 ESR1 (0.60) ESR1ESR2P4HBNR1H4PGR
SCHEMBL4258952 0.86 ESR1 (0.60) ESR1ESR2P4HBNR1H4PGR
SCHEMBL4253233 0.85 CYP3A4 (0.53) SNCAESR1ESR2P4HBTTR
SCHEMBL4253230 0.85 CYP3A4 (0.53) SNCAESR1ESR2P4HBTTR
SCHEMBL4259421 0.84 ESR1 (0.58) ESR1ESR2P4HBNR1H4PGR
SCHEMBL4259416 0.84 ESR1 (0.58) ESR1ESR2P4HBNR1H4PGR
SCHEMBL4262522 0.84 ESR1 (0.48) ESR1ESR2P4HBNR1H4PGR

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.