SCHEMBL7220319

SCHEMBL7220319

CCOC(=O)C(CCCCCCCCC1c2ccc(O)cc2SCC1(C)c1ccc(O)cc1)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.43

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
SCHEMBL7119390 0.92 ESR1 (0.39) ESR1
SCHEMBL7221248 0.91 ESR1 (0.52) ESR1
SCHEMBL7225027 0.91 ESR1 (0.52) ESR1
SCHEMBL7219515 0.91 ESR1 (0.52) ESR1
SCHEMBL7221154 0.91 ESR1 (0.52) ESR1
SCHEMBL7227372 0.90 ESR1 (0.38) ESR1
SCHEMBL7220419 0.89 ESR1 (0.44) ESR1
SCHEMBL7218944 0.88 ESR1 (0.54) ESR1
SCHEMBL7219789 0.88 ESR1 (0.54) ESR1
SCHEMBL7225982 0.88 ESR1 (0.54) ESR1

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-6552069-B1 Having anti-estrogenic activity; for use in therapy CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-04-22 US disclosed
EP-1241166-A1 3-METHYL-CHROMAN AND -THIOCHROMAN DERIVATIVES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-09-18 EP disclosed