SCHEMBL9503306

SCHEMBL9503306

CCCOc1c(F)c(F)c(-c2c(F)c(F)c(O)c(F)c2F)c(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.40
LTA4H P09960 1/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32

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
SCHEMBL10336320 0.94 ESR1 (0.37) ESR1LTA4HMGAMGAASI
SCHEMBL9504300 0.89 ESR1 (0.49) ESR1LTA4H
SCHEMBL9502690 0.87 ESR1 (0.44) ESR1LTA4H
SCHEMBL9502553 0.85 NR5A1 (0.43) ESR1LTA4H
SCHEMBL9506544 0.85 NR5A1 (0.43) ESR1LTA4H
SCHEMBL9502646 0.85 NR5A1 (0.43) ESR1LTA4H
SCHEMBL9503380 0.85 NR5A1 (0.43) ESR1LTA4H
SCHEMBL10336389 0.85 NR5A1 (0.43) ESR1LTA4H
SCHEMBL9504380 0.85 NR5A1 (0.43) ESR1LTA4H
SCHEMBL9502614 0.83 ESR1 (0.34) 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 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