SCHEMBL20179679

SCHEMBL20179679

Cc1cc2c(cc1OC(=O)C(C)(C)C)OCCC=C2OS(=O)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ELANE P08246 2/20 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
SCHEMBL20179916 0.89
SCHEMBL20179806 0.82 ELANE (0.38) MAPTELANE
SCHEMBL20165387 0.82 LMNA (0.33) LMNAMAPTNPSR1ELANE
SCHEMBL20179915 0.80 ELANE (0.32) ELANE
SCHEMBL20179914 0.78 ELANE (0.32) ELANE
SCHEMBL20179674 0.77 ELANE (0.31) ELANE
SCHEMBL20179641 0.72 ELANE (0.39) MAPTELANE
SCHEMBL20165091 0.71 PKM (0.31) ELANE
SCHEMBL20165329 0.71
SCHEMBL23335926 0.70 ELANE (0.32) ELANE

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