SCHEMBL29367114

SCHEMBL29367114

O=[N+]([O-])c1cccc(-c2cc(Cc3ccncc3)cc3cccnc23)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 12/20 1.00
PDE4B Q07343 6/20 1.00
PDE4D Q08499 12/20 0.63
PDE4C Q08493 7/20 0.63
TOP1 P11387 1/20 0.50
KMT2A Q03164 1/20 0.47
POLB P06746 1/20 0.46
LMNA P02545 1/20 0.45
HPGD P15428 1/20 0.45
ATM Q13315 1/20 0.45

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
SCHEMBL3698956 1.00 PDE4A (1.00) PDE4APDE4BPDE4DPDE4CTOP1
SCHEMBL7435677 0.92 PDE4A (0.85) PDE4APDE4BPDE4DPDE4CTOP1
SCHEMBL7442528 0.89 PDE4A (0.80) PDE4APDE4BPDE4DPDE4CTOP1
SCHEMBL7432993 0.89 PDE4A (0.80) PDE4APDE4BPDE4DPDE4CTOP1
SCHEMBL7434132 0.88 PDE4A (0.79) PDE4APDE4BPDE4DPDE4CTOP1
SCHEMBL7436868 0.86 PDE4A (0.76) PDE4APDE4BPDE4DPDE4CTOP1
SCHEMBL7441893 0.85 PDE4A (0.74) PDE4APDE4BPDE4DPDE4CTOP1
SCHEMBL7450694 0.85 PDE4A (0.74) PDE4APDE4BPDE4DPDE4CTOP1
SCHEMBL7439484 0.83 PDE4A (0.71) PDE4APDE4BPDE4DPDE4CTOP1
SCHEMBL7439997 0.83 PDE4A (0.71) PDE4APDE4BPDE4DPDE4CTOP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12122815-B2 GIP receptor agonist peptide compounds and uses thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-10-22 US disclosed
US-20230395254-A1 Nausea and Vomiting Management System TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-12-07 US disclosed
US-20230143604-A1 QW DOSING OF GIP RECEPTOR AGONIST PEPTIDE COMPOUNDS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-05-11 US disclosed
CN-115916812-A GIP receptor agonist peptide compounds and uses thereof 武田药品工业株式会社 2023-04-04 CN disclosed
EP-4126920-A2 GIF RECEPTOR AGONIST PEPTIDE COMPOUNDS AND USES THEREOF Takeda Pharmaceutical Company Limited (JP) 2023-02-08 EP disclosed
EP-4126921-A2 QD DOSING OF GIP RECEPTOR AGONIST PEPTIDE COMPOUNDS AND USES THEREOF Takeda Pharmaceutical Company Limited (JP) 2023-02-08 EP disclosed
CN-115335395-A QD administration of GIP receptor agonist peptide compounds and uses thereof 武田药品工业株式会社 2022-11-11 CN disclosed
US-20220227830-A1 QD DOSING OF GIP RECEPTOR AGONIST PEPTIDE COMPOUNDS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-07-21 US disclosed
US-20220135638-A1 GIP RECEPTOR AGONIST PEPTIDE COMPOUNDS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-05-05 US disclosed
WO-2022025035-A1 NAUSEA AND VOMITING MANAGEMENT SYSTEM TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-02-03 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 (4 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-20230143604-A1 QW DOSING OF GIP RECEPTOR AGONIST PEPTIDE COMPOUNDS AND USES THEREOF GIPR, GLP1R, GRPR PDE4A 323/4885PDE4B 477/4885PDE4D 548/4885
US-20220227830-A1 QD DOSING OF GIP RECEPTOR AGONIST PEPTIDE COMPOUNDS AND USES THEREOF GIPR, GLP1R, GRPR PDE4A 238/4885PDE4B 299/4885PDE4D 257/4885
US-20220135638-A1 GIP RECEPTOR AGONIST PEPTIDE COMPOUNDS AND USES THEREOF GIPR, GLP1R, VIPR1 PDE4A 142/4885PDE4B 179/4885PDE4D 215/4885
US-12122815-B2 GIP receptor agonist peptide compounds and uses thereof GIPR, GLP1R, GPR119 PDE4A 152/4885PDE4B 185/4885PDE4D 211/4885

“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.