SCHEMBL2457579

SCHEMBL2457579

Cc1ccc2nc3[nH]c(=O)[nH]c3cc2c1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 20/20 1.00
PDE3A Q14432 20/20 1.00
PDE2A O00408 2/20 1.00
P2RY12 Q9H244 1/20 1.00

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
Hydrochloric Acid SCHEMBL10756287 0.98 PDE3B (0.97) PDE3BPDE3APDE2AP2RY12
Water SCHEMBL10762992 0.98 PDE3B (0.97) PDE3BPDE3APDE2AP2RY12
SCHEMBL10757126 0.85 PDE3B (1.00) PDE3BPDE3APDE2AP2RY12
SCHEMBL10757167 0.81 PDE3B (1.00) PDE3BPDE3APDE2AP2RY12
Hydrochloric Acid SCHEMBL10758727 0.80 PDE3B (0.97) PDE3BPDE3APDE2AP2RY12
SCHEMBL10756405 0.80 PDE3B (1.00) PDE3BPDE3APDE2AP2RY12
SCHEMBL10760956 0.79 PDE3B (1.00) PDE3BPDE3APDE2AP2RY12
SCHEMBL10758549 0.74 PDE3B (1.00) PDE3BPDE3APDE2AP2RY12
SCHEMBL10757026 0.73 PDE3B (1.00) PDE3BPDE3APDE2AP2RY12
SCHEMBL32659810 0.73 PDE3B (0.59) PDE3BPDE3APDE2AP2RY12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4668686-A 1,3-DIHYDRO-2H-IMIDAZO/4,5-B/QUINOLINE-2-ONES BRISTOL-MYERS COMPANY (US) 1987-05-26 US claimed
CN-86102747-A The preparation method of imidazoquinoline antithombogehic cardiotonic agents 1987-02-04 CN claimed
US-20110224128-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF MUSCULAR DYSTROPHY WHALEN ANNE 2011-09-15 US disclosed
CN-1016175-B Imidazoquinoline antithrombin cardiotonic agents BRISTOL MYERS CO (US) 1992-04-08 CN disclosed
US-4668686-A 1,3-DIHYDRO-2H-IMIDAZO/4,5-B/QUINOLINE-2-ONES BRISTOL-MYERS COMPANY (US) 1987-05-26 US disclosed
CN-86102747-A The preparation method of imidazoquinoline antithombogehic cardiotonic agents 1987-02-04 CN 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-20110224128-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF MUSCULAR DYSTROPHY PYGM, TNNC1, MYOF PDE3B 55/4885PDE3A 49/4885PDE2A 63/4885

“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.