SCHEMBL8947073

SCHEMBL8947073

O=C(O)c1nc(-c2c(F)cccc2F)ns1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.46
ALB P02768 1/20 0.41
DHODH Q02127 3/20 0.37
PIM1 P11309 1/20 0.37
PIM3 Q86V86 1/20 0.37
KDM4E B2RXH2 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
ACMSD Q8TDX5 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
THRB P10828 1/20 0.34
NOTUM Q6P988 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
FAAH O00519 1/20 0.33
MAOA P21397 1/20 0.33

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
SCHEMBL8947253 0.82 NPC1 (0.46) DHODHACMSDNPC1RAB9AMEN1
SCHEMBL8947243 0.76 PIN1 (0.49) DHODHPIM1KDM4EFAAH
SCHEMBL17960860 0.75 ADORA3 (0.54) NPC1RAB9AMEN1KMT2AADORA3
SCHEMBL8947213 0.75 LMNA (0.49) NPC1RAB9AMEN1KMT2AFAAH
SCHEMBL8804128 0.72 NPC1 (0.34) TTRPIM1PIM3KDM4ENPC1
SCHEMBL18377841 0.72 ADORA3 (0.53) TTRPIM1PIM3KDM4EALOX15
SCHEMBL8947224 0.71 FABP4 (0.35) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL18378935 0.71 MEN1 (0.56) NPC1RAB9ATHRBMEN1KMT2A
SCHEMBL27508760 0.70 CYP19A1 (0.48) ALOX15TSHRNPC1RAB9AMEN1
SCHEMBL3647705 0.68 SMN1; SMN2 (0.56) KDM4EALOX15TSHRNPC1RAB9A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5583092-A PLANT ANTIGROWTH AGENTS AMERICAN CYANAMID COMPANY (US) 1996-12-10 US disclosed
EP-0726261-A1 Herbidical 1,2,4 thiadiazoles American Cyanamid Company (US) 1996-08-14 EP disclosed
EP-0726260-A1 Herbicidal (1,2,4)thiadiazoles AMERICAN CYANAMID COMPANY (US) 1996-08-14 EP disclosed