SCHEMBL7228337

SCHEMBL7228337

C[C](c1cccc(Cl)c1)c1cncc(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.47
PKM P14618 1/20 0.47
KDM4E B2RXH2 2/20 0.44
HTT P42858 1/20 0.44
PARP1 P09874 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
ALOX15 P16050 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ERCC5 P28715 1/20 0.40
FEN1 P39748 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KCNQ3 O43525 1/20 0.40
KCNQ2 O43526 1/20 0.40
KCNE1 P15382 1/20 0.40
KCNQ1 P51787 1/20 0.40
KCNQ5 Q9NR82 1/20 0.40
CTSL P07711 1/20 0.40

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
SCHEMBL4375606 0.84 PARP1 (0.56) PKMKDM4EHTTPARP1MEN1
SCHEMBL20659172 0.79 HTT (0.50) KDM4EHTTPARP1MEN1KMT2A
SCHEMBL22572715 0.77 HTT (0.49) PKMKDM4EHTTPARP1MEN1
SCHEMBL20659165 0.73 GRIN2B (0.46) KDM4EHTTPARP1MEN1KMT2A
SCHEMBL3096979 0.72 PARP1 (0.56) PKMKDM4EHTTPARP1MEN1
SCHEMBL1651203 0.71 HCAR2 (0.67) HCAR2
SCHEMBL13130693 0.71 HCAR2 (0.55) HCAR2
SCHEMBL5700540 0.71 HCAR2 (0.55) HCAR2
SCHEMBL11818982 0.70 PKM (0.64) HCAR2PKMKDM4EPARP1MEN1
SCHEMBL16951392 0.70 PARP1 (0.54) PKMKDM4EHTTPARP1MEN1

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-6573275-B1 Insecticidal compositions comprising and to methods of combatting and controlling insect pests therewith. SYNGENTA LIMITED (GB) 2003-06-03 US disclosed