SCHEMBL7900784

SCHEMBL7900784

CC(C)OC(=O)COCCOCCOCCOCCOCCN

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 2/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 2/20 0.34
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
HTT P42858 1/20 0.32
PPARG P37231 1/20 0.32
NCOA2 Q15596 1/20 0.32
NCOA1 Q15788 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
NCOA3 Q9Y6Q9 1/20 0.32
CYP2D6 P10635 1/20 0.30
TLR2 O60603 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
SCHEMBL28292932 0.96 TDP1 (0.40) TDP1LMNAMAPTTSHRHTT
SCHEMBL7651937 0.90 TDP1 (0.43) TDP1LMNAMAPTTSHRMEN1
SCHEMBL22360502 0.82 TDP1 (0.39) TDP1LMNAMAPTTSHRMEN1
SCHEMBL8862807 0.82 TDP1 (0.39) TDP1LMNAMAPTTSHRMEN1
SCHEMBL7651938 0.82 MAPT (0.40) TDP1LMNAMAPTTSHRMEN1
SCHEMBL1401407 0.82 MEN1 (0.44) TDP1LMNAMAPTTSHRMEN1
SCHEMBL1401325 0.82 MEN1 (0.44) TDP1LMNAMAPTTSHRMEN1
SCHEMBL25868407 0.81 TDP1 (0.57) TDP1LMNAMAPTTSHRMEN1
SCHEMBL12588874 0.80 TSHR (0.43) TDP1LMNAMAPTTSHRMEN1
SCHEMBL8100476 0.80 TDP1 (0.40) TDP1LMNAMAPTTSHRMEN1

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
US-6197299-B1 TARGET CELL IS CONTACTED WITH A TARGET CELL LYSIS EFFECTIVE AMOUNT OF A SOLUBLE MONOCLONAL ANTIBODY OR FRAGMENT CONJUGATE COVALENTLY LINKED BY PEPTIDE BOND LINKAGE TO A SUPERANTIGEN FOR THE LYSIS OF A TARGET CELL BY ASSISTANCE OF LYMPHOCYTES PHARMACIA & UPJOHN AB (SE) 2001-03-06 US disclosed
US-5858363-A WHEREIN ANTIBODY IS SPECIFIC FOR CELL SURFACE STRUCTURE AND SUPERANTIGEN IS CAPABLE OF ACTIVATING CYTOTOXIC T-CELLS PHARMACIA & UPJOHN AB (IT) 1999-01-12 US disclosed
EP-0610179-B1 TARGET SPECIFIC ANTIBODY-SUPERANTIGEN CONJUGATES AND THEIR PREPARATION PHARMACIA AB (SE) 1996-10-16 EP disclosed
EP-0610179-A1 TARGET SPECIFIC ANTIBODY-SUPERANTIGEN CONJUGATES AND THEIR PREPARATION. KABI PHARMACIA AB (SE) 1994-08-17 EP disclosed
EP-0540612-A1 HETEROBIFUNCTIONAL REAGENTS AND CONJUGATES WITH OXAALKYLENE UNITS FOR AMPHIPHILIC BRIDGE STRUCTURES Pharmacia AB (SE) 1993-05-12 EP disclosed
WO-1992001470-A1 TARGET SPECIFIC ANTIBODY-SUPERANTIGEN CONJUGATES AND THEIR PREPARATION KABI PHARMACIA AB (SE) 1992-02-06 WO disclosed
WO-1992001474-A1 HETEROBIFUNCTIONAL REAGENTS AND CONJUGATES WITH OXAALKYLENE UNITS FOR AMPHIPHILIC BRIDGE STRUCTURES KABI PHARMACIA AB (SE) 1992-02-06 WO disclosed