SCHEMBL15936749

SCHEMBL15936749

Brc1cccnc1OC1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 4/20 0.44
ALOX5AP P20292 3/20 0.42
FEN1 P39748 3/20 0.42
JAK3 P52333 2/20 0.41
FFAR4 Q5NUL3 4/20 0.41
PDE5A O76074 1/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
LOX P28300 1/20 0.39
LOXL2 Q9Y4K0 1/20 0.39
HRH4 Q9H3N8 1/20 0.37

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
SCHEMBL31441684 1.00 LRRK2 (0.44) LRRK2ALOX5APFEN1JAK3FFAR4
SCHEMBL31441792 0.98 LRRK2 (0.43) LRRK2ALOX5APFEN1JAK3FFAR4
SCHEMBL28083358 0.98 LRRK2 (0.43) LRRK2ALOX5APFEN1JAK3FFAR4
SCHEMBL7702753 0.95 LRRK2 (0.43) LRRK2ALOX5APFEN1FFAR4PDE5A
SCHEMBL24344501 0.91 ALOX5AP (0.40) LRRK2ALOX5APFEN1FFAR4
SCHEMBL17367699 0.85 ALOX5AP (0.48) ALOX5APFEN1
SCHEMBL15916710 0.85 ALOX5AP (0.48) ALOX5APFEN1
SCHEMBL15916711 0.85 ALOX5AP (0.48) ALOX5APFEN1
SCHEMBL15917169 0.83 NMT1 (0.46)
SCHEMBL15915695 0.83 LRRK2 (0.47) LRRK2ALOX5APFEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3495359-A1 FLAP MODULATORS Janssen Pharmaceutica NV (BE) 2019-06-12 EP disclosed
EP-3070085-B1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2019-01-09 EP disclosed
EP-3070085-A1 FLAP MODULATORS Janssen Pharmaceutica N.V. (BE) 2016-09-21 EP disclosed
WO-2014121055-A2 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2014-08-07 WO disclosed