SCHEMBL16655947

SCHEMBL16655947

Clc1cc(Cl)c(-c2cnc3ccccc3c2)c(Br)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BIRC5 O15392 1/20 0.51
PDGFRB P09619 4/20 0.47
PDGFRA P16234 4/20 0.47
CYP2A6 P11509 1/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
PIK3CD O00329 2/20 0.43
PIK3CA P42336 2/20 0.43
ALPL P05186 2/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
NISCH Q9Y2I1 1/20 0.41
CYP1A2 P05177 1/20 0.41
KDR P35968 1/20 0.40
MAP4K4 O95819 1/20 0.40
CSNK1G2 P78368 1/20 0.40
CLK4 Q9HAZ1 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40

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
SCHEMBL2846087 0.85 BIRC5 (0.55) BIRC5PDGFRBPDGFRACYP2A6CA12
SCHEMBL28286294 0.79 PDGFRB (0.54) BIRC5PDGFRBPDGFRACYP2A6CA12
SCHEMBL27191399 0.77 PDGFRB (0.61) BIRC5PDGFRBPDGFRACYP2A6CA12
SCHEMBL30911075 0.76 BIRC5 (0.55) BIRC5PDGFRBPDGFRACYP2A6CA12
SCHEMBL15949762 0.76 BIRC5 (0.55) BIRC5PDGFRBPDGFRACYP2A6CA12
SCHEMBL28284755 0.75 PDGFRB (0.50) BIRC5PDGFRBPDGFRACYP2A6PIK3CD
SCHEMBL32667946 0.74 PDGFRB (0.77) BIRC5PDGFRBPDGFRACYP2A6CA12
SCHEMBL2772360 0.74 PDGFRB (0.77) BIRC5PDGFRBPDGFRACYP2A6CA12
SCHEMBL29060493 0.74 PDGFRB (0.66) BIRC5PDGFRBPDGFRACYP2A6CA12
SCHEMBL29375315 0.74 PDGFRB (0.66) BIRC5PDGFRBPDGFRACYP2A6CA12

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-3057950-A1 PHENYL LINKED QUINOLINYL MODULATORS OF ROR-GAMMA-T Janssen Pharmaceutica N.V. (BE) 2016-08-24 EP disclosed
WO-2015057203-A1 PHENYL LINKED QUINOLINYL MODULATORS OF ROR-GAMMA-T JANSSEN PHARMACEUTICA NV (BE) 2015-04-23 WO disclosed