SCHEMBL13048086

SCHEMBL13048086

CN1CC2[C@H](C1)[C@H]2[N+](=O)[O-]

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.30
KMT2A Q03164 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
SCHEMBL3775802 1.00 MAPK1 (0.30) MAPK1KMT2A
SCHEMBL3775797 1.00 MAPK1 (0.30) MAPK1KMT2A
SCHEMBL3775804 1.00 MAPK1 (0.30) MAPK1KMT2A
SCHEMBL9947429 0.79
SCHEMBL9921597 0.74
SCHEMBL1014454 0.70
SCHEMBL11377457 0.69
SCHEMBL19565223 0.67
SCHEMBL19565210 0.67
SCHEMBL5627593 0.67

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-2010142978-A1 HETEROCYCLIC UREA DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2010-12-16 WO disclosed