SCHEMBL2053323

SCHEMBL2053323

CCCCCc1c(N)nc(-c2ccc(Cl)c(F)c2F)nc1C(=O)OC

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 4/20 0.39
TLR8 Q9NR97 3/20 0.36
KDM4E B2RXH2 1/20 0.34
PKM P14618 1/20 0.34
RCE1 Q9Y256 1/20 0.34
GRK6 P43250 2/20 0.33
MAPT P10636 1/20 0.33
DHFR P00374 1/20 0.33
TLR7 Q9NYK1 3/20 0.33
SCNN1A P37088 1/20 0.33
CNR1 P21554 1/20 0.32
DPP4 P27487 1/20 0.32
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
RAB9A P51151 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL1478316 0.81 KDM4E (0.39) KLKB1KDM4EPKMRCE1MAPT
SCHEMBL1918560 0.80 DPP4 (0.37) KLKB1KDM4EPKMRCE1DHFR
SCHEMBL11028213 0.80 KDM4E (0.39) KLKB1KDM4EPKMRCE1MAPT
SCHEMBL1918402 0.80 MEP1B (0.37) KLKB1KDM4EPKMRCE1DHFR
SCHEMBL1918801 0.79 KDM4E (0.36) KLKB1KDM4EPKMRCE1MAPT
SCHEMBL1397124 0.76 GRM6 (0.37) KLKB1KDM4EMAPTNPC1LMNA
SCHEMBL14627628 0.76 KDM4E (0.36) KLKB1KDM4EPKMRCE1RAB9A
SCHEMBL12499819 0.75 KDM4E (0.35) KLKB1KDM4EPKMRCE1LMNA
SCHEMBL1223300 0.75 KDM4E (0.38) KLKB1KDM4EPKMRCE1RAB9A
SCHEMBL16076571 0.75 KDM4E (0.38) KLKB1KDM4EPKMRCE1RAB9A

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-2327694-A1 Substituted 4-amino-picolinic acids and their use as herbicides Dow AgroSciences LLC (US) 2011-06-01 EP disclosed