SCHEMBL9502717

SCHEMBL9502717

CCCc1c(F)c(F)c(-c2c(F)c(F)c(O)c(F)c2F)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.35
DBH P09172 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
SCHEMBL10336447 0.94 ESR1 (0.33) ESR1
SCHEMBL8166647 0.93 ESR1 (0.38) ESR1DBH
SCHEMBL9504320 0.87 ESR1 (0.41) ESR1
SCHEMBL9506583 0.85
SCHEMBL9505791 0.85 ESR1 (0.40) ESR1
SCHEMBL9502594 0.84 ALOX5 (0.40) ESR1
SCHEMBL9504367 0.84 ALOX5 (0.40) ESR1
SCHEMBL9506578 0.84 ALOX5 (0.40) ESR1
SCHEMBL10336403 0.84 ALOX5 (0.40) ESR1
SCHEMBL9505834 0.81 ESR1 (0.33) ESR1DBH

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0364548-B1 OCTAFLUOROBIPHENYLS MERCK PATENT GmbH (DE) 1993-06-09 EP disclosed