SCHEMBL19236409

SCHEMBL19236409

Nc1nc(=O)c2c([nH]1)NCCN2C=O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 2/20 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
SCHEMBL3454166 0.70 PNP (0.32) NOS1
SCHEMBL318462 0.64
SCHEMBL14685027 0.61 NOS1 (0.36) NOS1
Urea SCHEMBL4457654 0.60 NPSR1 (0.33)
SCHEMBL7077081 0.60 KDM4E (0.33)
SCHEMBL29509848 0.59 CDC7 (0.33)
SCHEMBL2273420 0.59
SCHEMBL676635 0.58 CYP3A4 (0.32)
SCHEMBL7362056 0.57 KDM4E (0.33)
SCHEMBL294168 0.57

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
WO-2017133517-A1 PHOSPHAMIDE DERIVATIVE, METHOD FOR MANUFACTURING THE SAME, AND USES THEREOF 四川海思科制药有限公司 2017-08-10 WO disclosed