SCHEMBL20179748

SCHEMBL20179748

Cc1cc(C2=C(c3ccc(OC4CCN(CCCF)C4)cc3)c3ccc(OS(=O)(=O)C(F)(F)F)cc3SCC2)ccc1Cl

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 19/20 0.62
AGTR2 P50052 1/20 0.49

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
SCHEMBL29756783 1.00 ESR1 (0.62) ESR1AGTR2
SCHEMBL20165256 1.00 ESR1 (0.62) ESR1AGTR2
SCHEMBL20179713 0.89 ESR1 (0.62) ESR1
SCHEMBL29756660 0.89 ESR1 (0.62) ESR1
SCHEMBL20179739 0.88 ESR1 (0.69) ESR1AGTR2
SCHEMBL29756668 0.88 ESR1 (0.69) ESR1AGTR2
SCHEMBL20165117 0.87 ESR1 (0.78) ESR1
SCHEMBL29756864 0.87 ESR1 (0.78) ESR1
SCHEMBL20165195 0.87 ESR1 (0.62) ESR1
SCHEMBL29756718 0.87 ESR1 (0.62) 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