SCHEMBL2334063

SCHEMBL2334063

O=C=NC(=O)C(=O)CCBr

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
CYP3A4 P08684 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL11467408 0.75
SCHEMBL655528 0.70
SCHEMBL10568538 0.69 LMNA (0.43) KDM4EMEN1USP2ALDH1A1LMNA
SCHEMBL4866622 0.68
SCHEMBL29396780 0.66
Lithium Ion SCHEMBL29397058 0.64
SCHEMBL29391432 0.64
SCHEMBL3167705 0.64
Potassium Ion SCHEMBL29397036 0.64
Potassium Ion SCHEMBL29392094 0.63 SLC34A1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1385637-B1 IMPROVED RAMAN-ACTIVE TAGGANTS AND THEIR RECOGNITION QUANTAG SYSTEMS INC (US) 2011-08-24 EP disclosed
EP-1385637-A4 IMPROVED RAMAN-ACTIVE TAGGANTS AND THEIR RECOGNITION QUANTAG SYSTEMS INC (US) 2006-10-18 EP disclosed
US-20040058058-A1 Prefatory anti-forgery protection and consecutive machine-assisted authentication of genuine documents and other values SHCHEGOLIKHIN ALEXANDER NIKITO (RU) 2004-03-25 US disclosed
EP-1385637-A1 IMPROVED RAMAN-ACTIVE TAGGANTS AND THEIR RECOGNITION Quantag Systems, Inc. (US) 2004-02-04 EP disclosed
US-6610351-B2 Spectroscopy QUANTAG SYSTEMS, INC. 2003-08-26 US disclosed
WO-2002085543-A1 IMPROVED RAMAN-ACTIVE TAGGANTS AND THEIR RECOGNITION QUANTAG SYSTEMS, INC. (US) 2002-10-31 WO disclosed
US-20020025490-A1 Spectroscopy CHROMATIC TECHNOLOGIES, INC. 2002-02-28 US disclosed