SCHEMBL3633857

SCHEMBL3633857

N#Cc1ccc(N(Cc2cc(F)c(F)c(F)c2)C2CCNCC2)nc1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 8/20 0.43
SLC6A4 P31645 8/20 0.43
SLC6A3 Q01959 7/20 0.43
JAK2 O60674 4/20 0.37
JAK1 P23458 2/20 0.37
JAK3 P52333 2/20 0.37
KDM1A O60341 5/20 0.36
NOS2 P35228 1/20 0.36
MAPKAPK2 P49137 1/20 0.35
CTSL P07711 1/20 0.35

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
SCHEMBL3633393 0.90 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3JAK2JAK1
SCHEMBL3972380 0.86 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3JAK2JAK1
SCHEMBL3634073 0.84 TACR1 (0.44) SLC6A2SLC6A4SLC6A3KDM1A
SCHEMBL3821333 0.82 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3NOS2
SCHEMBL3972485 0.82 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3JAK2JAK3
SCHEMBL3631945 0.82 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3KDM1A
SCHEMBL3978579 0.82 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3JAK2JAK1
SCHEMBL3973401 0.80 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3JAK2JAK1
SCHEMBL3972502 0.79 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3JAK2JAK1
SCHEMBL3973888 0.79 IKBKB (0.40) SLC6A2SLC6A4SLC6A3JAK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2148872-A1 PYRIDINE DERIVATIVES AS FAST DISSOCIATING DOPAMINE 2 RECEPTOR ANTAGONISTS Janssen Pharmaceutica, N.V. (BE) 2010-02-03 EP disclosed
WO-2008128994-A1 PYRIDINE DERIVATIVES AS FAST DISSOCIATING DOPAMINE 2 RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA N.V. (BE) 2008-10-30 WO disclosed