SCHEMBL11220799

SCHEMBL11220799

NS(=O)(=O)N(CCCl)CCCl

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.55
CA1 P00915 2/20 0.55
CA12 O43570 1/20 0.55
CA14 Q9ULX7 1/20 0.55
LMNA P02545 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.32
TP53 P04637 1/20 0.30
TSHR P16473 1/20 0.30
HTT P42858 1/20 0.30
HBB P68871 1/20 0.30

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
SCHEMBL28258892 0.79 CA2 (0.37) CA2CA1CA12CA14LMNA
SCHEMBL1038516 0.71 LMNA (0.33) LMNAMEN1KMT2AMAPTTP53
SCHEMBL1213173 0.71 CA2 (0.55) CA2CA1CA12CA14MAPT
SCHEMBL995245 0.71 MEN1 (0.39) CA2CA1CA12CA14LMNA
SCHEMBL5708648 0.69 LMNA (0.33) CA2CA1CA12CA14LMNA
SCHEMBL1218665 0.69 CA2 (0.52) CA2CA1CA12CA14TSHR
SCHEMBL11590057 0.69 MEN1 (0.32) LMNAMEN1KMT2AMAPT
SCHEMBL11571285 0.65 CA1 (0.35) CA2CA1CA12CA14LMNA
Methane SCHEMBL8657931 0.65 CA1 (0.68) CA2CA1CA12CA14TP53
SCHEMBL293336 0.65 CA2 (0.68) CA2CA1CA12CA14TP53

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-4336377-A Basic dioxazine compounds CIBA-GEIGY CORPORATION (US) 1982-06-22 US disclosed