SCHEMBL3078288

SCHEMBL3078288

CCOC(=O)CCOc1cc(C(=C2CC(C)(C)CC(C)(C)C2)c2ccccc2)ccc1C

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
TDP1 Q9NUW8 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TSHR P16473 1/20 0.37
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.35
CASP6 P55212 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
RAB9A P51151 1/20 0.35
RXRA P19793 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
SCHEMBL3078835 0.86 TSHR (0.53) TDP1MEN1KMT2ATSHRALDH1A1
SCHEMBL3074996 0.83 PTGDR2 (0.44) MEN1KMT2ATSHRPOLBL3MBTL1
SCHEMBL3075855 0.82 LTA4H (0.47) TDP1TSHRALDH1A1POLBL3MBTL1
SCHEMBL3085602 0.82 ALDH1A1 (0.36) TDP1MEN1KMT2ATSHRALDH1A1
SCHEMBL3085581 0.80 RARB (0.35) TDP1MEN1KMT2ATSHRALDH1A1
SCHEMBL3080491 0.78 ALDH1A1 (0.33) MEN1KMT2ATSHRALDH1A1POLB
SCHEMBL3467951 0.74 CYSLTR2 (0.43) L3MBTL1
SCHEMBL3087766 0.73 HRH2 (0.44) L3MBTL1
SCHEMBL14098920 0.73 NPC1 (0.34) RAB9ARXRA
SCHEMBL21991830 0.71 TSHR (0.65) APOBEC3AAPOBEC3GTDP1MEN1KMT2A

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 APOBEC3A 4598/4885APOBEC3G 4643/4885TDP1 4606/4885
US-20080167360-A1 Cycloalkylidene Compounds as Selective Estrogen Receptor Modulators GPER1, ESR2, ESRRG APOBEC3A 4598/4885APOBEC3G 4643/4885TDP1 4606/4885

“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.