SCHEMBL7499338

SCHEMBL7499338

O=C(O)C1CCN(c2nc(NCc3ccc(O)c(O)c3)c3cc(Cl)ccc3n2)CC1

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.75
PDE4B Q07343 2/20 0.75
PDE4C Q08493 2/20 0.75
PDE4D Q08499 2/20 0.75
PDE2A O00408 1/20 0.66
PDE5A O76074 1/20 0.66
PDE1A P54750 1/20 0.66
PDE1B Q01064 1/20 0.66
PDE1C Q14123 1/20 0.66
HRH4 Q9H3N8 14/20 0.57
HTR3A P46098 5/20 0.56
HRH1 P35367 2/20 0.52
CTNNB1 P35222 4/20 0.49
TCF7L2 Q9NQB0 4/20 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
SCHEMBL7794280 0.87 PDE4A (0.71) PDE4APDE4BPDE4CPDE4DPDE2A
SCHEMBL149748 0.85 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE2A
Hydrochloric Acid SCHEMBL7502602 0.85 PDE4A (0.98) PDE4APDE4BPDE4CPDE4DPDE2A
Potassium SCHEMBL7504150 0.85 PDE4A (0.98) PDE4APDE4BPDE4CPDE4DPDE2A
Hydrochloric Acid SCHEMBL29801523 0.85 PDE4A (0.98) PDE4APDE4BPDE4CPDE4DPDE2A
SCHEMBL5917668 0.85 PDE4A (0.98) PDE4APDE4BPDE4CPDE4DPDE2A
SCHEMBL5917665 0.85 PDE4A (0.98) PDE4APDE4BPDE4CPDE4DPDE2A
SCHEMBL7447328 0.85 PDE4A (0.72) PDE4APDE4BPDE4CPDE4DPDE2A
SCHEMBL7504141 0.85 PDE4A (0.98) PDE4APDE4BPDE4CPDE4DPDE2A
SCHEMBL7503592 0.85 PDE4A (0.69) PDE4APDE4BPDE4CPDE4DPDE2A

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-0607439-B1 NITROGENOUS HETEROCYCLIC COMPOUND EISAI CO LTD (JP) 2002-01-09 EP disclosed
US-20010031760-A1 Method of treating a patient having precancerous lesions with quinazoline derivatives PAMUKCU RIFAT (US) 2001-10-18 US disclosed
US-6262059-B1 Method of treating a patient having precancerous lesions with quinazoline derivatives CELL PATHWAYS, INC. 2001-07-17 US disclosed
US-5801180-A ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS EISAI CO., LTD. (JP) 1998-09-01 US disclosed
US-5693652-A Benzimidazoles for ischemic heart conditions EISAI CO., LTD. (JP) 1997-12-02 US disclosed
US-5576322-A Anti-ischemic 2,4-diaminoquinazolines EISAI CO., LTD. (JP) 1996-11-19 US disclosed
EP-0607439-A1 NITROGENOUS HETEROCYCLIC COMPOUND Eisai Co., Ltd. (JP) 1994-07-27 EP 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-20010031760-A1 Method of treating a patient having precancerous lesions with quinazoline derivatives MKI67, PCNA, NQO2 PDE4A 1596/4885PDE4B 1852/4885PDE4C 2100/4885

“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.