SCHEMBL4852297

SCHEMBL4852297

CCC12CCc3cc(OC)ccc3C1=CC(=O)C2

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 8/20 0.59
ESR1 P03372 5/20 0.48
PRNP P04156 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
MPO P05164 1/20 0.43
AR P10275 2/20 0.41
CYP24A1 Q07973 2/20 0.40
CYP27A1 Q02318 1/20 0.40
MALT1 Q9UDY8 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 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
SCHEMBL4857333 0.88 ESR2 (0.62) ESR2ESR1PRNPSMN1; SMN2MPO
SCHEMBL4860203 0.83 ESR2 (0.61) ESR2ESR1PRNPSMN1; SMN2MPO
SCHEMBL2422946 0.80 ESR2 (0.73) ESR2ESR1
SCHEMBL4859486 0.79 ESR2 (0.60) ESR2ESR1
SCHEMBL6151438 0.78 ESR2 (0.58) ESR2ESR1
SCHEMBL5582360 0.76 ESR2 (0.72) ESR2ESR1ARCYP24A1
SCHEMBL4856450 0.76 PRNP (0.69) ESR2ESR1PRNPSMN1; SMN2MPO
SCHEMBL4857748 0.76 PRNP (0.53) ESR2ESR1PRNPSMN1; SMN2MPO
SCHEMBL5582489 0.75 ESR2 (0.60) ESR2ESR1AR
SCHEMBL2420233 0.74 ESR2 (0.69) ESR2ESR1PRNPSMN1; SMN2AR

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-7432284-B2 Estrogen receptor modulators MERCK & CO., INC. (US) 2008-10-07 US disclosed
US-7432284-B2 Estrogen receptor modulators MERCK & CO., INC. (US) 2008-10-07 US disclosed
US-7432284-B2 Estrogen receptor modulators MERCK & CO., INC. (US) 2008-10-07 US disclosed
US-20060041003-A1 Estrogen receptor modulators MERCK SHARP & DOHME LLC 2006-02-23 US disclosed
EP-1551820-A2 ESTROGEN RECEPTOR MODULATORS Merck & Co., Inc. (US) 2005-07-13 EP disclosed
WO-2004026887-A2 ESTROGEN RECEPTOR MODULATORS MERCK & CO., INC. (US) 2004-04-01 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 (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-20060041003-A1 Estrogen receptor modulators GPER1, ESR2, ESR1 ESR2 2/4885ESR1 3/4885PRNP 1632/4885

“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.