SCHEMBL29188908

SCHEMBL29188908

C=CCOC#N.O=C1C=CC(=O)N1.O=C1C=CC(=O)N1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
CCR6 P51684 1/20 0.41
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA9 Q16790 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
SCHEMBL5136796 0.78 GSK3A (0.50) GSK3AGSK3BCCR6CA12CA1
SCHEMBL644334 0.77
SCHEMBL7902501 0.75 GSK3A (0.46) GSK3AGSK3BCCR6
Acrylonitrile SCHEMBL9357575 0.73 GSK3A (0.55) GSK3AGSK3BCCR6
Allyl Alcohol SCHEMBL27281433 0.73 GSK3A (0.55) GSK3AGSK3BCCR6
Vinyl Chloride SCHEMBL10516224 0.70 GSK3A (0.65) GSK3AGSK3BCCR6
Butadiene SCHEMBL1020118 0.67 GSK3A (0.69) GSK3AGSK3BCCR6
SCHEMBL28256443 0.67 GSK3A (0.69) GSK3AGSK3BCCR6
SCHEMBL7729231 0.67 GSK3A (0.52) GSK3AGSK3BCCR6
Water SCHEMBL7139391 0.67 GSK3A (0.92) GSK3AGSK3BCCR6

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-117820641-A Bismaleimide-allyl cyanate copolymer and preparation method thereof 中国航空工业集团公司济南特种结构研究所 2024-04-05 CN claimed
CN-117820641-A Bismaleimide-allyl cyanate copolymer and preparation method thereof 中国航空工业集团公司济南特种结构研究所 2024-04-05 CN disclosed