SCHEMBL4853543

SCHEMBL4853543

CCCCC1CCc2c(cc(F)c(OC)c2Cl)C1=O

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP24A1 Q07973 3/20 0.33
CYP27A1 Q02318 2/20 0.33
SGPL1 O95470 1/20 0.33
S1PR1 P21453 1/20 0.33
CRBN Q96SW2 1/20 0.32
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
CYP19A1 P11511 1/20 0.31
HTR2C P28335 2/20 0.31
CYP26A1 O43174 1/20 0.31
HTR2A P28223 3/20 0.30
DRD2 P14416 2/20 0.30
HTR1A P08908 1/20 0.30
DRD4 P21917 1/20 0.30
DRD3 P35462 1/20 0.30

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
SCHEMBL2419510 0.88 MEN1 (0.31)
SCHEMBL2423359 0.80 CYP24A1 (0.31) CYP24A1CYP27A1CRBNTHRATHRB
SCHEMBL2416248 0.76 HTR2A (0.32) HTR2A
SCHEMBL4857653 0.75 ALDH1A1 (0.44)
SCHEMBL2421172 0.74 HTR1A (0.33) HTR2CHTR2ADRD2HTR1ADRD4
SCHEMBL6152154 0.74 DRD3 (0.32) SGPL1HTR2CHTR2ADRD2HTR1A
SCHEMBL8460075 0.71 THRA (0.37) SGPL1S1PR1THRATHRBCYP19A1
SCHEMBL4852334 0.71 KDM4E (0.45) DRD2DRD3
SCHEMBL5336349 0.71
SCHEMBL6137841 0.70 CRBN (0.32) CRBN

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 CYP24A1 319/4885CYP27A1 279/4885SGPL1 3286/4885

“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.