SCHEMBL21706150

SCHEMBL21706150

NCC(=O)NCCOCCOCCOCCNc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 4/20 0.68
▸ MAP1LC3B Q9GZQ8 3/20 0.56
▸ CRBN Q96SW2 7/20 0.53
▸ IKZF1 Q13422 2/20 0.52
▸ IKZF3 Q9UKT9 2/20 0.52
▸ BRD4 O60885 1/20 0.52
▸ TNF P01375 1/20 0.52
▸ IL1B P01584 1/20 0.52
▸ DDB1 Q16531 1/20 0.52
▸ DYRK2 Q92630 1/20 0.52
▸ AXL P30530 4/20 0.50
▸ CSNK1A1 P48729 1/20 0.50
▸ HDAC3 O15379 1/20 0.49
▸ HDAC1 Q13547 1/20 0.49

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
SCHEMBL21070007 0.91 STAT3 (0.71) STAT3MAP1LC3BCRBNIKZF1IKZF3
SCHEMBL28989000 0.90 STAT3 (0.69) STAT3MAP1LC3BCRBNIKZF1IKZF3
SCHEMBL30438189 0.90 STAT3 (0.65) STAT3MAP1LC3BCRBNIKZF1IKZF3
SCHEMBL19451338 0.90 STAT3 (0.65) STAT3MAP1LC3BCRBNIKZF1IKZF3
SCHEMBL19451343 0.90 STAT3 (0.65) STAT3MAP1LC3BCRBNIKZF1IKZF3
SCHEMBL30376389 0.90 STAT3 (0.65) STAT3MAP1LC3BCRBNIKZF1IKZF3
SCHEMBL20913625 0.90 STAT3 (0.65) STAT3MAP1LC3BCRBNIKZF1IKZF3
SCHEMBL19451341 0.90 STAT3 (0.65) STAT3MAP1LC3BCRBNIKZF1IKZF3
SCHEMBL30241717 0.90 STAT3 (0.65) STAT3MAP1LC3BCRBNIKZF1IKZF3
SCHEMBL28339005 0.89 STAT3 (0.65) STAT3MAP1LC3BCRBNIKZF1IKZF3

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
US-11236103-B2 Bifunctional compounds BIOTHERYX, INC. (US) 2022-02-01 — — US disclosed
US-20200048277-A1 BIFUNCTIONAL COMPOUNDS BIOTHERYX, INC. 2020-02-13 — — 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 (2 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-20200048277-A1 BIFUNCTIONAL COMPOUNDS CDK2, CDK6, CDK5 STAT3 1702/4885MAP1LC3B 2766/4885CRBN 1405/4885
US-11236103-B2 Bifunctional compounds CDK2, CDK6, CDK5 STAT3 1702/4885MAP1LC3B 2766/4885CRBN 1405/4885

“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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