SCHEMBL8523530

SCHEMBL8523530

CNS(=O)(=O)c1cccc(NC(=N)N(C)c2cccc3ccccc23)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.46
LMNA P02545 2/20 0.42
PTBP1 P26599 1/20 0.42
IDH1 O75874 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TNNI3K Q59H18 7/20 0.41
EGFR P00533 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
BRAF P15056 2/20 0.40
RAB9A P51151 2/20 0.39
ALDH1A1 P00352 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
NQO2 P16083 1/20 0.38
MTNR1A P48039 1/20 0.38

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
SCHEMBL6720743 0.88 SIGMAR1 (0.48) SIGMAR1LMNAL3MBTL1RAB9AALDH1A1
SCHEMBL8556316 0.80 POLB (0.51) LMNAPTBP1L3MBTL1TNNI3KRAB9A
SCHEMBL6719248 0.76 SIGMAR1 (0.50) SIGMAR1RAB9AALDH1A1MEN1KMT2A
SCHEMBL6725035 0.76 SIGMAR1 (0.62) SIGMAR1LMNAL3MBTL1TDP1MEN1
SCHEMBL6720634 0.75 MEN1 (0.51) SIGMAR1LMNAL3MBTL1TDP1RAB9A
Hydrochloric Acid SCHEMBL7410846 0.75 SIGMAR1 (0.60) SIGMAR1LMNAL3MBTL1TDP1MEN1
SCHEMBL6724149 0.74 SIGMAR1 (0.48) SIGMAR1LMNARAB9AALDH1A1MEN1
SCHEMBL6720746 0.73 SIGMAR1 (0.47) SIGMAR1L3MBTL1RAB9AMEN1KMT2A
SCHEMBL4151992 0.73 LMNA (0.52) LMNAPTBP1TNNI3KEGFRBRAF
SCHEMBL8337122 0.72 SIGMAR1 (0.49) SIGMAR1RAB9AALDH1A1MEN1KMT2A

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
WO-1999002145-A1 COMBINATION DRUG THERAPIES COMPRISING AMINOGLYCOSIDE ANTIBIOTICS AND N,N'-DISUBSTITUTED GUANIDINES CAMBRIDGE NEUROSCIENCE, INC. (US) 1999-01-21 WO disclosed