SCHEMBL17067682

SCHEMBL17067682

Cc1ncc(-c2cnc3ccccc3c2)cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 4/20 0.56
PDGFRA P16234 4/20 0.56
CYP1A2 P05177 1/20 0.53
CYP2A6 P11509 1/20 0.53
BIRC5 O15392 1/20 0.51
PIK3CD O00329 2/20 0.50
PIK3CA P42336 2/20 0.50
MAP4K4 O95819 1/20 0.49
CSNK1G2 P78368 1/20 0.49
CLK4 Q9HAZ1 1/20 0.49
MKNK2 Q9HBH9 1/20 0.49
MAP4K5 Q9Y4K4 1/20 0.49
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 1/20 0.48
NISCH Q9Y2I1 1/20 0.44
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
NPC1 O15118 1/20 0.44

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
SCHEMBL2772360 0.82 PDGFRB (0.77) PDGFRBPDGFRACYP1A2CYP2A6BIRC5
SCHEMBL32667946 0.82 PDGFRB (0.77) PDGFRBPDGFRACYP1A2CYP2A6BIRC5
SCHEMBL2554717 0.80 ALDH1A1 (0.47) PDGFRBPDGFRAPIK3CDPIK3CAMAP4K4
SCHEMBL23555381 0.77 PDGFRB (0.66) PDGFRBPDGFRACYP1A2CYP2A6BIRC5
SCHEMBL29375315 0.77 PDGFRB (0.66) PDGFRBPDGFRACYP1A2CYP2A6BIRC5
SCHEMBL27191399 0.77 PDGFRB (0.61) PDGFRBPDGFRACYP1A2CYP2A6BIRC5
SCHEMBL29060493 0.77 PDGFRB (0.66) PDGFRBPDGFRACYP1A2CYP2A6BIRC5
SCHEMBL8370258 0.77 PDGFRB (0.66) PDGFRBPDGFRACYP1A2CYP2A6BIRC5
SCHEMBL708999 0.76 PDGFRB (0.75) PDGFRBPDGFRACYP1A2CYP2A6BIRC5
SCHEMBL2195152 0.76 CYP1A2 (0.61) PDGFRBPDGFRACYP1A2CYP2A6BIRC5

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
EP-2773631-B1 PESTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2015-09-09 EP disclosed