SCHEMBL5577075

SCHEMBL5577075

O=[N+]([O-])CC([O-])=S.O=[N+]([O-])CC([O-])=S.[Ni+2]

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TSHR P16473 1/20 0.33
CA5A P35218 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
BLM P54132 1/20 0.31
HBB P68871 1/20 0.31
KMT2A Q03164 1/20 0.31
HIF1A Q16665 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
Potassium Ion SCHEMBL9365744 0.87 TSHR (0.35) ALDH1A1TDP1TSHR
Nitroacetic Acid SCHEMBL13859133 0.73 MEN1 (0.38) ALDH1A1TDP1TSHRCA5ACA5B
SCHEMBL28356166 0.71
SCHEMBL4669132 0.71
SCHEMBL11779118 0.69
Potassium Ion SCHEMBL9365740 0.69 ALDH1A1 (0.33) ALDH1A1TDP1TSHRCA5ACA5B
Nitroacetic Acid SCHEMBL11879474 0.67
Nitroacetic Acid SCHEMBL11577983 0.67
Nitroacetic Acid SCHEMBL30721731 0.67 MEN1 (0.38) ALDH1A1TDP1TSHRCA5ACA5B
Nitroacetic Acid SCHEMBL5933850 0.67 MEN1 (0.38) ALDH1A1TDP1TSHRCA5ACA5B

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-20070106069-A1 Non-Human Primate Fc Receptors and Methods of Use GENENTECH, INC. (US) 2007-05-10 US disclosed
EP-1456222-A4 NON-HUMAN PRIMATE FC RECEPTORS AND METHODS OF USE GENENTECH INC (US) 2006-12-06 EP disclosed
US-6911321-B2 Non-human primate Fc receptors and methods of use GENENTECH, INC. (US) 2005-06-28 US disclosed
US-20050054046-A1 Non-human primate Fc receptors and methods of use GENENTECH, INC. (US) 2005-03-10 US disclosed
EP-1456222-A2 NON-HUMAN PRIMATE FC RECEPTORS AND METHODS OF USE GENENTECH, INC. (US) 2004-09-15 EP disclosed
US-20030190614-A1 Non-human primate Fc receptors and methods of use GENENTECH, INC. 2003-10-09 US disclosed
WO-2003054213-A2 NON-HUMAN PRIMATE Fc RECEPTORS AND METHODS OF USE GENENTECH, INC. (US) 2003-07-03 WO disclosed