SCHEMBL11070176

SCHEMBL11070176

O=C=NS(=O)(=O)c1cc(OC(F)F)ccc1OC(F)F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
PKM P14618 1/20 0.36
MAPT P10636 5/20 0.34
POLB P06746 3/20 0.34
LMNA P02545 3/20 0.34
HTT P42858 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ALDH1A1 P00352 5/20 0.33
ALOX15 P16050 1/20 0.33
GFER P55789 1/20 0.33
ADAM17 P78536 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.32
GAA P10253 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
DRD1 P21728 1/20 0.31
FAAH O00519 2/20 0.31

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
SCHEMBL31358642 0.80 SLC22A12 (0.42) KMT2APOLBHTTSMN1; SMN2DRD1
SCHEMBL7843852 0.80 SLC22A12 (0.42) KMT2APOLBHTTSMN1; SMN2DRD1
SCHEMBL11063047 0.76 PTGES2 (0.42) MEN1KMT2APKMMAPTPOLB
SCHEMBL9870656 0.76 DRD1 (0.39) MEN1KMT2APKMMAPTLMNA
SCHEMBL11068840 0.76 TRPV4 (0.44) MEN1KMT2APKMMAPTPOLB
SCHEMBL10963311 0.70 PTGES2 (0.34) MAPT
SCHEMBL11065586 0.68 TBXA2R (0.42) MEN1KMT2APKMMAPTPOLB
SCHEMBL38652703 0.68 ALDH1A1 (0.51) MAPTPOLBNPSR1ALDH1A1TSHR
SCHEMBL10747381 0.67 DAGLA (0.38) MEN1KMT2APKMMAPTLMNA
SCHEMBL10870054 0.67 L3MBTL1 (0.42) KMT2APKMMAPTSMN1; SMN2GAA

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-4444583-A POSTEMERGENCE HERBICIDES AND PLANT GROWTH REGULATORS CIBA-GEIGY CORPORATION (US) 1984-04-24 US disclosed