SCHEMBL18513832

SCHEMBL18513832

C=C(C)C(=O)N(C)OCC(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTT P42858 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
SCHEMBL28214326 0.75 TDP1 (0.33)
SCHEMBL8085073 0.75 THRB (0.36)
SCHEMBL22973238 0.73 TSHR (0.39) HTT
SCHEMBL17350177 0.72 TSHR (0.37)
SCHEMBL472262 0.71 TSHR (0.48)
SCHEMBL238944 0.69 TSHR (0.43)
SCHEMBL18125076 0.69
SCHEMBL237000 0.68
SCHEMBL36595 0.67 TSHR (0.48) HTT
SCHEMBL28031899 0.67 TSHR (0.48) HTT

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-2017024408-A1 ARYL-SUBSTITUTED DIHYDROQUINOLINONES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS NEOMED INSTITUTE (CA) 2017-02-16 WO disclosed