SCHEMBL7813618

SCHEMBL7813618

CCCCCCCCC(C1c2ccc(O)cc2SCC1(C)c1ccc(O)cc1)C(CC)(CCCCC(F)(F)C(F)(F)F)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.34

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
SCHEMBL7813295 1.00 ESR1 (0.34) ESR1
SCHEMBL7805977 0.98 ESR1 (0.34) ESR1
SCHEMBL7815801 0.92 ESR1 (0.37) ESR1
SCHEMBL7816173 0.92 ESR1 (0.37) ESR1
SCHEMBL7819407 0.90 ESR1 (0.37) ESR1
SCHEMBL7813110 0.85 ESR1 (0.34) ESR1
SCHEMBL7815892 0.85 ESR1 (0.34) ESR1
SCHEMBL7819405 0.83 ESR1 (0.34) ESR1
SCHEMBL6935467 0.81 ESR1 (0.33) ESR1
SCHEMBL7813213 0.81 ESR1 (0.33) 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
EP-1087959-A1 NOVEL BENZOPYRAN OR THIOBENZOPYRAN DERIVATIVES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2001-04-04 EP claimed
WO-1999065893-A1 NOVEL BENZOPYRAN OR THIOBENZOPYRAN DERIVATIVES C & C RESEARCH LABORATORIES (KR) 1999-12-23 WO claimed