SCHEMBL29167141

SCHEMBL29167141

NC1=NC(N)(C2CCOCC2)NC(N)=N1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 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
SCHEMBL29197982 0.73
SCHEMBL29167065 0.72 BACE1 (0.31) BACE1
SCHEMBL30740038 0.68
SCHEMBL2843355 0.67 BACE1 (0.31) BACE1
SCHEMBL132856 0.60
SCHEMBL89917 0.56
Hydrochloric Acid SCHEMBL11397460 0.56 NOS2 (0.34)
SCHEMBL31740598 0.56
SCHEMBL17652239 0.51
SCHEMBL16441054 0.50

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
CN-117624137-A Triazine skeleton small molecule heparin reversal agent and preparation method and application thereof 中国药科大学 2024-03-01 CN disclosed