SCHEMBL4594754

SCHEMBL4594754

CC(C)(C)c1ccnc(CCl)n1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.36
MBOAT4 Q96T53 1/20 0.33
NUDT1 P36639 1/20 0.30

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
SCHEMBL1157053 0.82 SYK (0.36) SYKMBOAT4NUDT1
SCHEMBL19598857 0.80 SYK (0.36) SYKMBOAT4NUDT1
SCHEMBL23767530 0.80 MBOAT4 (0.38) SYKMBOAT4NUDT1
SCHEMBL16841615 0.77 NUDT1 (0.34) SYKMBOAT4NUDT1
SCHEMBL22097217 0.77 SYK (0.34) SYKMBOAT4
SCHEMBL30423979 0.77 MBOAT4 (0.32) MBOAT4
SCHEMBL16544510 0.76 TLR8 (0.36) SYKMBOAT4
SCHEMBL16544519 0.74 KCNH2 (0.38) SYK
SCHEMBL2018538 0.72 SYK (0.38) SYK
SCHEMBL15264888 0.72

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-1555259-B1 Malononitrile compounds as pesticides SUMITOMO CHEMICAL CO (JP) 2008-01-02 EP disclosed
EP-1555259-A1 Malononitrile compounds as pesticides Sumitomo Chemical Company, Limited (JP) 2005-07-20 EP disclosed