SCHEMBL29192811

SCHEMBL29192811

CCC(C)C#N.COC(=O)C(C)(C)N=NC(C)(C)C(=O)OC

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.33
CTSS P25774 3/20 0.32
CTSK P43235 3/20 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
SCHEMBL28985473 0.84 DPP4 (0.32) DPP4CTSSCTSK
SCHEMBL30551797 0.79 CTSS (0.30) CTSSCTSK
SCHEMBL28677 0.75 DGAT1 (0.44)
SCHEMBL14299531 0.75 DGAT1 (0.44)
SCHEMBL28678 0.75 DGAT1 (0.44)
SCHEMBL30887376 0.75
SCHEMBL4366080 0.74 MMP8 (0.33) CTSSCTSK
SCHEMBL3220564 0.73 CTSS (0.32) CTSSCTSK
SCHEMBL11352515 0.73 DGAT1 (0.33)
SCHEMBL13935578 0.72 MMP8 (0.35) DPP4CTSSCTSK

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-109071740-B Process for producing maleimide-based block copolymer 株式会社 日本触媒 2024-04-12 CN disclosed