SCHEMBL8362134

SCHEMBL8362134

CC(=NO)C(C)(C)NCCCN

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.33
PAOX Q6QHF9 3/20 0.32
CASP2 P42575 2/20 0.31
CA12 O43570 2/20 0.31
F13A1 P00488 2/20 0.31
CA2 P00918 2/20 0.31
CYP1A2 P05177 2/20 0.31
ALOX15 P16050 2/20 0.31
CA4 P22748 2/20 0.31
CA6 P23280 2/20 0.31
CA5A P35218 2/20 0.31
THPO P40225 2/20 0.31
CA7 P43166 2/20 0.31
CA9 Q16790 2/20 0.31
CA14 Q9ULX7 2/20 0.31
CA5B Q9Y2D0 2/20 0.31
MEN1 O00255 1/20 0.31
CYP2C19 P33261 1/20 0.31
RECQL P46063 1/20 0.31
KMT2A Q03164 1/20 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
SCHEMBL8362130 1.00 POLB (0.33) POLBPAOXCASP2CA12F13A1
SCHEMBL8476517 0.94 PAOX (0.38) POLBPAOXCASP2CA12F13A1
SCHEMBL8476513 0.94 PAOX (0.38) POLBPAOXCASP2CA12F13A1
SCHEMBL8476697 0.92 PAOX (0.41) POLBPAOXCA12F13A1CA2
SCHEMBL8476699 0.92 PAOX (0.41) POLBPAOXCA12F13A1CA2
SCHEMBL7128026 0.88 POLB (0.35) POLBTSHR
Upenazime SCHEMBL1477985 0.87 POLB (0.37) POLBTSHR
SCHEMBL8693325 0.87 POLB (0.37) POLBTSHR
SCHEMBL8693335 0.87 POLB (0.37) POLBTSHR
SCHEMBL15144439 0.85 POLB (0.36) POLBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5993774-A Metal-oxime chelates for use as radiopharmaceutical agents AMERSHAM INTERNATIONAL PLC (GB) 1999-11-30 US disclosed
EP-0663900-B1 METAL-OXIME CHELATES FOR USE AS RADIOPHARMACEUTICAL AGENTS NYCOMED AMERSHAM PLC (GB) 1999-09-22 EP disclosed
EP-0663900-A1 METAL-OXIME CHELATES FOR USE AS RADIOPHARMACEUTICAL AGENTS AMERSHAM INTERNATIONAL plc (GB) 1995-07-26 EP disclosed
WO-1994008949-A2 METAL-OXIME CHELATES FOR USE AS RADIOPHARMACEUTICAL AGENTS AMERSHAM INTERNATIONAL PLC (GB) 1994-04-28 WO disclosed