SCHEMBL28876359

SCHEMBL28876359

CC(CCCN=C=O)CN=C=O.N=C=O.N=C=O.[CH2]C

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL28747658 0.96 — —
SCHEMBL35780 0.91 — —
SCHEMBL9065755 0.89 — —
SCHEMBL8677223 0.87 — —
SCHEMBL7703603 0.85 LMNA (0.31) —
SCHEMBL7555491 0.83 LMNA (0.30) —
SCHEMBL2012541 0.83 LMNA (0.30) —
SCHEMBL2148105 0.83 LMNA (0.30) —
SCHEMBL28093107 0.80 LMNA (0.36) —
SCHEMBL11660910 0.80 LMNA (0.36) —

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-110300820-A Method for producing elastic fiber, method for producing elastic fiber product, elastic fiber, and elastic fiber product 巴斯夫欧洲公司 2019-10-01 — — CN disclosed
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