SCHEMBL24777871

SCHEMBL24777871

[N-]=[N+]=NCCC(=O)Nc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 14/20 0.57
▸ MAP1LC3B Q9GZQ8 6/20 0.54
▸ BRD4 O60885 3/20 0.54
▸ IKZF1 Q13422 2/20 0.53
▸ TNF P01375 1/20 0.53
▸ IL1B P01584 1/20 0.53
▸ DDB1 Q16531 1/20 0.53
▸ IKZF3 Q9UKT9 1/20 0.53
▸ CSNK1A1 P48729 1/20 0.51

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
SCHEMBL13621972 0.92 CRBN (0.58) CRBNMAP1LC3BBRD4IKZF1TNF
SCHEMBL30250216 0.92 CRBN (0.58) CRBNMAP1LC3BBRD4IKZF1TNF
SCHEMBL30891812 0.91 MAP1LC3B (0.55) CRBNMAP1LC3BBRD4
SCHEMBL25031848 0.91 MAP1LC3B (0.52) CRBNMAP1LC3BBRD4IKZF3CSNK1A1
SCHEMBL25756460 0.91 MAP1LC3B (0.52) CRBNMAP1LC3BBRD4IKZF3CSNK1A1
SCHEMBL30891792 0.90 MAP1LC3B (0.52) CRBNMAP1LC3BBRD4DDB1
SCHEMBL23037219 0.89 CRBN (0.52) CRBNMAP1LC3BBRD4IKZF1TNF
SCHEMBL25756351 0.89 MAP1LC3B (0.49) CRBNMAP1LC3BBRD4
SCHEMBL26321010 0.88 CRBN (0.64) CRBNMAP1LC3BBRD4IKZF1TNF
SCHEMBL26321021 0.88 CRBN (0.64) CRBNMAP1LC3BBRD4IKZF1TNF

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-116854667-A Proteolytic targeted chimera for targeted degradation of PD-L1 and application thereof 浙江工业大学 2023-10-10 — — CN disclosed
US-11530195-B1 Protacs targeting coronavirus 3CL protease and preparation method and application thereof Shaanxi Panlong Pharmaceutical Co., Ltd. (CN) 2022-12-20 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11530195-B1 Protacs targeting coronavirus 3CL protease and preparation method and application thereof TMPRSS2, TMPRSS11D, CTRL CRBN 118/4885MAP1LC3B 913/4885BRD4 996/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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