SCHEMBL11779441

SCHEMBL11779441

NC(=O)c1[nH]nnc1O.[NaH]

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.38
GDA Q9Y2T3 1/20 0.33

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
SCHEMBL11778525 0.98
SCHEMBL7313659 0.74 PDPK1 (0.39) PDPK1GDA
SCHEMBL11778806 0.65
SCHEMBL13512899 0.63 RAB9A (0.34) PDPK1
SCHEMBL11526731 0.62 PDPK1 (0.33) PDPK1
SCHEMBL11530628 0.60 PDPK1 (0.31) PDPK1
SCHEMBL8409991 0.59
SCHEMBL8080735 0.59
SCHEMBL28456635 0.59
SCHEMBL11529909 0.59

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3948885-A ANTIVIRAL ICN PHARMACEUTICALS, INC. (US) 1976-04-06 US disclosed