SCHEMBL28051409

SCHEMBL28051409

O=C=NCCn1cc[nH]c1=O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.32

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
SCHEMBL28051379 0.81
SCHEMBL28028901 0.71 PDE4B (0.32) PDE4B
SCHEMBL1306115 0.71 PDE4B (0.32) PDE4B
SCHEMBL4448355 0.71
SCHEMBL28051348 0.71
SCHEMBL28051378 0.68 ALDH1A1 (0.36) PDE4B
SCHEMBL28284139 0.68 PDE4B (0.34) PDE4B
SCHEMBL27590844 0.67 HTT (0.44) PDE4B
SCHEMBL28051280 0.67 ALDH1A1 (0.38) PDE4B
SCHEMBL28805561 0.64 PDE4B (0.32) PDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105229041-B Nitrogen-containing heterocycle compound improved polyalkene and adhesive composition containing it 东洋纺株式会社 2019-04-19 CN disclosed
CN-105229041-A Nitrogen-containing heterocycle compound modified polyolefin and containing its binder composition TOYO BOSEKI 2016-01-06 CN disclosed