SCHEMBL31465489

SCHEMBL31465489

O=[N+]([O-])c1cnc(Cl)nc1NC12CCC(O)(CC1)C2

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PIN1 Q13526 14/20 0.48
▸ GSK3B P49841 5/20 0.45
▸ GSK3A P49840 4/20 0.45
▸ AURKA O14965 1/20 0.43
▸ PRKCQ Q04759 1/20 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
SCHEMBL5805693 0.82 GSK3A (0.66) PIN1GSK3BGSK3AAURKA
SCHEMBL17168791 0.78 PIN1 (0.53) PIN1GSK3BGSK3A
SCHEMBL31465483 0.78 GSK3A (0.32) GSK3BGSK3A
SCHEMBL31465472 0.77 IRAK4 (0.32) PIN1GSK3BGSK3AAURKA
SCHEMBL15221431 0.74 PIN1 (0.47) PIN1GSK3BGSK3A
SCHEMBL15221514 0.72 PIN1 (0.45) PIN1GSK3BGSK3A
SCHEMBL29777792 0.72 PIN1 (0.47) PIN1
SCHEMBL26921555 0.72 PIN1 (0.47) PIN1
SCHEMBL31465569 0.71 SYK (0.47) —
SCHEMBL21492475 0.71 PIN1 (0.44) PIN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250263753-A1 BRIDGED CYCLE-BASED INHIBITORS OF DNA-DEPENDENT PROTEIN KINASE AND COMPOSITIONS AND APPLICATION IN GENE EDITING JUNO THERAPEUTICS INC (US) 2025-08-21 — — US disclosed
US-20250241912-A1 USE OF BRIDGED CYCLE-BASED INHIBITORS OF DNA-DEPENDENT PROTEIN KINASE IN COMBINATION OF DNA POLYMERASE THETA INHIBITOR AND COMPOSITIONS AND APPLICATION IN GENE EDITING JUNO THERAPEUTICS INC (US) 2025-07-31 — — US disclosed
WO-2025049253-A1 BRIDGED CYCLE‑BASED INHIBITORS OF DNA‑DEPENDENT PROTEIN KINASE AND COMPOSITIONS AND APPLICATION IN GENE EDITING JUNO THERAPEUTICS, INC. (US) 2025-03-06 — — WO 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-20250263753-A1 BRIDGED CYCLE-BASED INHIBITORS OF DNA-DEPENDENT PROTEIN KINASE AND COMPOSITIONS AND APPLICATION IN GENE EDITING DTYMK, DCK, PHKG1 PIN1 505/4885GSK3B 193/4885GSK3A 168/4885
US-20250241912-A1 USE OF BRIDGED CYCLE-BASED INHIBITORS OF DNA-DEPENDENT PROTEIN KINASE IN COMBINATION OF DNA POLYMERASE THETA INHIBITOR AND COMPOSITIONS AND APPLICATION IN GENE EDITING POLQ, POLK, POLG PIN1 543/4885GSK3B 204/4885GSK3A 199/4885

“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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