SCHEMBL14627628

SCHEMBL14627628

COC(=O)c1nc(-c2ccc(C)cc2F)nc(N)c1Cl.COC(=O)c1nc(-c2ccc(Cl)c(F)c2F)nc(N)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.36
PKM P14618 1/20 0.36
RCE1 Q9Y256 1/20 0.36
ALDH1A1 P00352 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HSD17B10 Q99714 1/20 0.35
KLKB1 P03952 3/20 0.35
PDGFRB P09619 4/20 0.35
KDR P35968 4/20 0.35
CYP46A1 Q9Y6A2 1/20 0.35
RAB9A P51151 1/20 0.34
GRM2 Q14416 2/20 0.33
PTGES O14684 1/20 0.33
DHPS P49366 1/20 0.33
ALPL P05186 1/20 0.33
AGPAT2 O15120 1/20 0.32
NQO2 P16083 1/20 0.32
GAA P10253 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
SCHEMBL1480327 0.93 KDM4E (0.40) KDM4EPKMRCE1ALDH1A1SMN1; SMN2
SCHEMBL1478316 0.90 KDM4E (0.39) KDM4EPKMRCE1ALDH1A1SMN1; SMN2
SCHEMBL1223300 0.84 KDM4E (0.38) KDM4EPKMRCE1ALDH1A1SMN1; SMN2
SCHEMBL16076571 0.84 KDM4E (0.38) KDM4EPKMRCE1ALDH1A1SMN1; SMN2
SCHEMBL1477994 0.82 ABL1 (0.42) KDM4EPKMRCE1ALDH1A1SMN1; SMN2
SCHEMBL1477905 0.82 KDM4E (0.36) KDM4EPKMRCE1ALDH1A1SMN1; SMN2
SCHEMBL679753 0.82 KDM4E (0.38) KDM4EPKMRCE1ALDH1A1SMN1; SMN2
SCHEMBL29769728 0.82 KDM4E (0.38) KDM4EPKMRCE1ALDH1A1SMN1; SMN2
SCHEMBL11028213 0.80 KDM4E (0.39) KDM4EPKMRCE1ALDH1A1SMN1; SMN2
SCHEMBL1477857 0.80 KDM4E (0.40) KDM4EPKMRCE1ALDH1A1SMN1; SMN2

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-8357633-B2 2-(2-fluoro-substituted phenyl)-6-amino-5-chloro-4-pyrimidinecarboxylates and their use as herbicides DOW AGROSCIENCES, LLC (US) 2013-01-22 US claimed