SCHEMBL20179636

SCHEMBL20179636

Oc1ccc2c(c1)SCC(c1ccc(OC(F)(F)F)cc1)=C2c1ccc(OC2CCN(CCCF)C2)cc1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 20/20 0.73

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
SCHEMBL20165181 1.00 ESR1 (0.73) ESR1
SCHEMBL29756876 1.00 ESR1 (0.73) ESR1
SCHEMBL20165455 0.93 ESR1 (0.76) ESR1
SCHEMBL29756666 0.92 ESR1 (0.74) ESR1
SCHEMBL20165240 0.92 ESR1 (0.74) ESR1
SCHEMBL20165431 0.90 ESR1 (0.60) ESR1
SCHEMBL29771878 0.90 ESR1 (0.60) ESR1
SCHEMBL29756700 0.90 ESR1 (0.64) ESR1
SCHEMBL20165063 0.90 ESR1 (0.64) ESR1
SCHEMBL29756912 0.90 ESR1 (0.64) 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
WO-2018091153-A1 NOVEL SUBSTITUTED N-(3-FLUOROPROPYL)-PYRROLIDINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC USES THEREOF SANOFI (FR) 2018-05-24 WO disclosed