SCHEMBL6153982

SCHEMBL6153982

CC(C)(C)OC(=O)CN(CCN(CC(=O)OC(C)(C)C)CC(CCCCN)N(CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 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
SCHEMBL7601678 0.81 CPB2 (0.33) CPB2
SCHEMBL8061791 0.81 NR1D1 (0.31)
SCHEMBL9001946 0.81 NR1D1 (0.31)
SCHEMBL5543850 0.80 CPB2 (0.33) CPB2
SCHEMBL2567911 0.80 CPB2 (0.33) CPB2
SCHEMBL7881945 0.80 CPB2 (0.36) CPB2
SCHEMBL6232124 0.79 EPOR (0.40) CPB2
SCHEMBL6232568 0.78 EPOR (0.40) CPB2
SCHEMBL422349 0.77 CHRM2 (0.36) CPB2
SCHEMBL6534683 0.77 NR1D1 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0948361-B1 MAGNETIC RESONANCE BLOOD POOL AGENTS MALLINCKRODT INC (US) 2005-01-26 EP disclosed
EP-0948361-A4 MAGNETIC RESONANCE BLOOD POOL AGENTS MALLINCKRODT MEDICAL INC (US) 2001-02-07 EP disclosed
EP-0948361-A1 MAGNETIC RESONANCE BLOOD POOL AGENTS MALLINCKRODT MEDICAL, INC. (US) 1999-10-13 EP disclosed
US-5961953-A CONTAINING BICYCLO(2.2.2)OCTANE, ADAMANTANE, OR DICYCLOHEXYLACETYL GROUPS AND CHELATING GROUPS MALLINCKRODT INC. (US) 1999-10-05 US disclosed
US-5888476-A ADMINISTERING A GADOLINIUM COMPLEX AS A CONTRAST AGENT FOR MAGNETIC RESONANCE IMAGING WHICH INCREASE RELAXIVITY OF WATER PROTONS SURROUNDING THE TISSUE MALLINCKRODT MEDICAL, INC. (US) 1999-03-30 US disclosed
WO-1998020908-A1 MAGNETIC RESONANCE BLOOD POOL AGENTS MALLINCKRODT MEDICAL, INC. (US) 1998-05-22 WO disclosed