SCHEMBL17801752

SCHEMBL17801752

c1cnc(Nc2ccc3ncsc3c2)nc1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.69
IKBKB O14920 12/20 0.59
CHUK O15111 3/20 0.52
PLK1 P53350 1/20 0.52
KDR P35968 3/20 0.51
INSR P06213 1/20 0.51
CSF1R P07333 1/20 0.51
PDGFRB P09619 1/20 0.51
PDGFRA P16234 1/20 0.51
TEK Q02763 1/20 0.51
LRRK2 Q5S007 1/20 0.50
RIPK1 Q13546 1/20 0.49

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
SCHEMBL14651384 0.83 SYK (1.00) SYKIKBKBCHUK
SCHEMBL13035473 0.82 SYK (0.64) SYKIKBKBCHUKPLK1KDR
SCHEMBL6131243 0.81 SYK (0.56) SYKIKBKBKDRINSRCSF1R
SCHEMBL6394544 0.80 KDR (0.67) SYKIKBKBCHUKPLK1KDR
SCHEMBL20311432 0.79 SYK (0.49) SYKIKBKBKDRINSRCSF1R
SCHEMBL17484071 0.77 KDR (0.59) SYKIKBKBCHUKPLK1KDR
SCHEMBL6395906 0.77 KDR (0.60) SYKIKBKBCHUKPLK1KDR
SCHEMBL2229449 0.76 TGFBR1 (0.56) SYKIKBKBKDRINSRCSF1R
SCHEMBL616687 0.75 IRAK4 (0.51) SYKKDRINSRCSF1RPDGFRB
SCHEMBL5564384 0.75 DYRK1A (0.49) SYKKDRLRRK2

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-3227283-A1 BICYCLIC COMPOUNDS AS PEST CONTROL AGENTS Bayer CropScience AG (DE) 2017-10-11 EP disclosed
WO-2016087371-A1 BICYCLIC COMPOUNDS AS PEST CONTROL AGENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-06-09 WO disclosed