SCHEMBL8987904

SCHEMBL8987904

COCc1nccc(NC(=O)Cc2ccc(Oc3ccc(C(F)(F)F)cc3)cc2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 1/20 0.47
RIOK2 Q9BVS4 3/20 0.47
LTA4H P09960 1/20 0.46
EPHX2 P34913 1/20 0.46
TEK Q02763 2/20 0.45
KDR P35968 1/20 0.45
MAPK10 P53779 3/20 0.45
ALDH1A1 P00352 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ANO1 Q5XXA6 1/20 0.43
MAPK8 P45983 1/20 0.43
GSK3B P49841 1/20 0.42
MAPK14 Q16539 1/20 0.42
RORC P51449 1/20 0.42
NLRP3 Q96P20 1/20 0.42
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
GSK3A P49840 1/20 0.41
CDK5 Q00535 1/20 0.41

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
SCHEMBL8988013 0.90 RIOK2 (0.48) CSNK1DRIOK2LTA4HEPHX2TEK
SCHEMBL8987795 0.89 MAPK10 (0.47) CSNK1DRIOK2LTA4HEPHX2KDR
SCHEMBL8987985 0.88 MAPK10 (0.47) CSNK1DRIOK2MAPK10ALDH1A1SMN1; SMN2
SCHEMBL8987685 0.86 EPHX2 (0.47) CSNK1DRIOK2LTA4HEPHX2TEK
SCHEMBL8987787 0.85 RIOK2 (0.50) CSNK1DRIOK2LTA4HEPHX2TEK
SCHEMBL8987854 0.83 RIOK2 (0.48) CSNK1DRIOK2LTA4HEPHX2TEK
SCHEMBL8987654 0.83 RIOK2 (0.51) CSNK1DRIOK2LTA4HEPHX2TEK
SCHEMBL8987987 0.80 RIOK2 (0.47) CSNK1DRIOK2LTA4HEPHX2TEK
SCHEMBL8987780 0.79 RIOK2 (0.46) CSNK1DRIOK2LTA4HEPHX2MAPK10
SCHEMBL8987704 0.78 EPHX2 (0.51) CSNK1DRIOK2LTA4HEPHX2KDR

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
US-5556859-A N-(4-pyrimidinyl)amide pesticides DOWELANCO (US) 1996-09-17 US disclosed