SCHEMBL7448963

SCHEMBL7448963

C=CCOC(=O)NC(=N)OC(N)=O

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.45
CACNA1B Q00975 1/20 0.45
APBA1 Q02410 1/20 0.45
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP3A4 P08684 1/20 0.33
TSHR P16473 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CASP1 P29466 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
SCHEMBL7312659 0.82 MAPT (0.50) MAPTCACNA1BAPBA1MEN1KMT2A
SCHEMBL1023939 0.79 MAPT (0.60) MAPTCACNA1BAPBA1MEN1KMT2A
SCHEMBL729016 0.77 MAPT (0.50) MAPTCACNA1BAPBA1MEN1KMT2A
SCHEMBL3015689 0.76 MAPT (0.47) MAPTCACNA1BAPBA1MEN1KMT2A
SCHEMBL2357850 0.74 MAPT (0.44) MAPTCACNA1BAPBA1MEN1KMT2A
SCHEMBL11336079 0.73 MAPT (0.41) MAPTCACNA1BAPBA1MEN1KMT2A
SCHEMBL18621628 0.71 MAPT (0.40) MAPTCACNA1BAPBA1MEN1KMT2A
SCHEMBL27372531 0.71 MAPT (0.46) MAPTCACNA1BAPBA1MEN1KMT2A
SCHEMBL6971720 0.71
SCHEMBL1076421 0.71 MAPT (0.46) MAPTCACNA1BAPBA1MEN1KMT2A

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-0971916-A1 N-(ARGINYL)BENZENESULPHONAMIDE DERIVATIVES AND USE THEREOF AS ANTITHROMBOTIC AGENTS SANOFI-SYNTHELABO (FR) 2000-01-19 EP disclosed
WO-1998042700-A1 N-(ARGINYL)BENZENESULPHONAMIDE DERIVATIVES AND USE THEREOF AS ANTITHROMBOTIC AGENTS SANOFI-SYNTHELABO (FR) 1998-10-01 WO disclosed