SCHEMBL7109948

SCHEMBL7109948

CCCCn1c(=O)c2[nH]cnc2n(C)c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 10/20 1.00
ADORA2A P29274 10/20 1.00
PDE4B Q07343 10/20 1.00
PDE4C Q08493 10/20 1.00
PDE4D Q08499 10/20 1.00
ADORA2B P29275 10/20 0.77
ADORA3 P0DMS8 3/20 0.68
CHIT1 Q13231 1/20 0.68
CHIA Q9BZP6 1/20 0.68
CFTR P13569 1/20 0.66

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
SCHEMBL21381258 0.96 PDE4A (0.92) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL7458212 0.94 PDE4A (0.89) PDE4AADORA2APDE4BPDE4CPDE4D
Iodide SCHEMBL28973314 0.94 PDE4A (0.89) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL8656750 0.93 PDE4A (0.87) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL7460178 0.91 PDE4A (1.00) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL3186630 0.91 PDE4A (0.94) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL11361392 0.90 PDE4A (0.91) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL21381240 0.88 ADORA2B (0.94) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL21381259 0.88 PDE4A (1.00) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL3842077 0.88 PDE4A (1.00) PDE4AADORA2APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0956855-B1 Immunosuppressive effects of 8 substituted xanthine derivatives LEUVEN K U RES & DEV (BE) 2003-03-12 EP claimed
EP-0956855-A1 Immunosuppressive effects of 8-substituted xanthine derivatives K.U. Leuven Research & Development (BE) 1999-11-17 EP claimed
EP-4662319-A2 PERSONALIZED CRISPR PROFILING FOR CANCER Integrate Bioscience LLC (US) 2025-12-17 EP disclosed
WO-2024168301-A2 PERSONALIZED CRISPR PROFILING FOR CANCER FUNCTION ONCOLOGY, INC. (US) 2024-08-15 WO disclosed
EP-3042934-B1 COLORED COMPOSITION, CURED FILM, COLOR FILTER, COLOR-FILTER MANUFACTURING METHOD, SOLID-STATE IMAGING ELEMENT, IMAGE DISPLAY DEVICE, POLYMER, AND XANTHENE DYE FUJIFILM CORP (JP) 2022-11-09 EP disclosed
US-11225481-B2 Xanthine derivative inhibitors of BET proteins CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2022-01-18 US disclosed
US-20190292186-A1 XANTHINE DERIVATIVE INHIBITORS OF BET PROTEINS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2019-09-26 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-20190292186-A1 XANTHINE DERIVATIVE INHIBITORS OF BET PROTEINS BET1, BRD4, BRD3 PDE4A 1873/4885ADORA2A 3171/4885PDE4B 1806/4885
US-11225481-B2 Xanthine derivative inhibitors of BET proteins BET1, BRD4, BRD3 PDE4A 1873/4885ADORA2A 3171/4885PDE4B 1806/4885

“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.