SCHEMBL22115481

SCHEMBL22115481

FC(F)Oc1ccc(I)c(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.38
ALOX15 P16050 2/20 0.38
GFER P55789 1/20 0.38
ADAM17 P78536 1/20 0.38
MAPT P10636 4/20 0.38
RAB9A P51151 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NPC1 O15118 2/20 0.38
CRHR1 P34998 4/20 0.37
LMNA P02545 4/20 0.36
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
GAA P10253 3/20 0.35
HTT P42858 2/20 0.35
POLB P06746 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
KCNJ5 P48544 1/20 0.35

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
SCHEMBL31241283 1.00 NPSR1 (0.38) NPSR1ALOX15GFERADAM17MAPT
SCHEMBL900879 0.76 ALOX15 (0.38) NPSR1ALOX15GFERADAM17MAPT
SCHEMBL4635786 0.76 ALOX15 (0.38) ALOX15GFERADAM17MAPTRAB9A
SCHEMBL12491911 0.76 CYP3A4 (0.45) NPSR1ALOX15GFERADAM17MAPT
SCHEMBL4342358 0.76 ALOX15 (0.42) NPSR1ALOX15GFERADAM17MAPT
SCHEMBL900880 0.76 LMNA (0.48) NPSR1ALOX15GFERADAM17MAPT
SCHEMBL508083 0.76 GPR3 (0.44) ALOX15MAPTRAB9ASMN1; SMN2NPC1
SCHEMBL34474782 0.76 GPR3 (0.44) ALOX15MAPTRAB9ASMN1; SMN2NPC1
SCHEMBL16974786 0.73 PPARG (0.54) NPSR1ALOX15GFERADAM17MAPT
SCHEMBL12883146 0.73 MAPT (0.39) NPSR1ALOX15GFERADAM17MAPT

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-3670501-A1 SUBSTITUTED [1,2,4]TRIAZOLE COMPOUNDS AS FUNGICIDES BASF SE (DE) 2020-06-24 EP disclosed
EP-3670501-A1 SUBSTITUTED [1,2,4]TRIAZOLE COMPOUNDS AS FUNGICIDES BASF SE (DE) 2020-06-24 EP disclosed