SCHEMBL6513766

SCHEMBL6513766

CC(C)N(C(C)C)P(O)OC(C)(C#N)C#N.NP(O)O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL1763992 0.94
SCHEMBL1763990 0.74
SCHEMBL994101 0.73
SCHEMBL1603737 0.71
SCHEMBL9494298 0.68
SCHEMBL994100 0.68
SCHEMBL1004709 0.66
SCHEMBL26187546 0.63
SCHEMBL9494293 0.62
SCHEMBL1763993 0.60

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6936472-B2 Method for synthesizing a specific, surface-bound polymer uniformly over an element of a molecular array AGILENT TECHNOLOGIES, INC. (US) 2005-08-30 US disclosed
US-20020034830-A1 Method for synthesizing a specific, surface-bound polymer uniformly over an element of a molecular array EARHART JONATHAN P (US) 2002-03-21 US disclosed
US-6300137-B1 APPLYING CAPPING AGENT TO THE SUBSTRATE TO DEACTIVATE ANY UNREACTED DEPROTECTED BOUND OLIGONUCLEOTIDE, 5'-PROTECTED NUCLEOSIDE PHOSPHORAMIDITES ARE APPLIED IN DROPLETS HAVING COVERING VOLUMES TO FULLY COVER THE FIRST DROPLET; ACCURACY AGILENT TECHNOLOGIES INC. 2001-10-09 US disclosed