SCHEMBL3087766

SCHEMBL3087766

CCOC(=O)CCCOc1ccc(C(=C2CC(C)(C)CC(C)(C)C2)c2ccc(F)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 1/20 0.44
HRH1 P35367 1/20 0.44
MAPT P10636 1/20 0.43
BRD4 O60885 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
PDK2 Q15119 1/20 0.41
CYSLTR2 Q9NS75 1/20 0.41
CYSLTR1 Q9Y271 1/20 0.41
PTPN1 P18031 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
LTA4H P09960 1/20 0.39
MAOB P27338 1/20 0.39

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
SCHEMBL3467951 0.90 CYSLTR2 (0.43) MAPTBRD4SMN1; SMN2PDK2CYSLTR2
SCHEMBL3075855 0.90 LTA4H (0.47) MAPTBRD4SMN1; SMN2PDK2CYSLTR2
SCHEMBL3075680 0.87 LTA4H (0.46) SMN1; SMN2L3MBTL1LTA4H
SCHEMBL3257350 0.81 BRD4 (0.54) HRH2HRH1MAPTBRD4SMN1; SMN2
SCHEMBL3082749 0.81 NR1I2 (0.43) MAOB
SCHEMBL4617631 0.79 BCL9 (0.44) MAPTSMN1; SMN2
SCHEMBL3069744 0.78 LMNA (0.42) SMN1; SMN2L3MBTL1MAOB
SCHEMBL4728795 0.78 PPARA (0.40) HRH2HRH1SMN1; SMN2MAOB
SCHEMBL3063182 0.78 PPARA (0.54) MAPTCYSLTR2CYSLTR1L3MBTL1
SCHEMBL5493279 0.77 LTA4H (0.53) HRH2HRH1MAPTBRD4SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100261772-A1 Cycloalkylidene Compounds As Selective Estrogen Receptor Modulators FANG JING 2010-10-14 US disclosed
EP-1891026-B1 CYCLOALKYLIDENE COMPOUNDS AS SELECTIVE ESTROGEN RECEPTOR MODULATORS GLAXOSMITHKLINE LLC (US) 2010-07-14 EP disclosed
US-7723393-B2 Cycloalkylidene compounds as selective estrogen receptor modulators GLAXOSMITHKLINE LLC (US) 2010-05-25 US disclosed
US-20080167360-A1 Cycloalkylidene Compounds as Selective Estrogen Receptor Modulators SMITHKLINE BEECHAM CORPORATION 2008-07-10 US disclosed
EP-1891026-A2 CYCLOALKYLIDENE COMPOUNDS AS SELECTIVE ESTROGEN RECEPTOR MODULATORS Smithkline Beecham Corporation (US) 2008-02-27 EP disclosed
WO-2006127871-A2 CYCLOALKYLIDENE COMPOUNDS AS SELECTIVE ESTROGEN RECEPTOR MODULATORS SMITHKLINE BEECHAM CORPORATION (US) 2006-11-30 WO 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 (2 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-20100261772-A1 Cycloalkylidene Compounds As Selective Estrogen Receptor Modulators GPER1, ESR2, ESRRG HRH2 766/4885HRH1 929/4885MAPT 4195/4885
US-20080167360-A1 Cycloalkylidene Compounds as Selective Estrogen Receptor Modulators GPER1, ESR2, ESRRG HRH2 766/4885HRH1 929/4885MAPT 4195/4885

“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.