SCHEMBL6234593

SCHEMBL6234593

CC1SC(=O)NN=C1c1ccc(N)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 12/20 0.54
PDE3A Q14432 12/20 0.54
PDE4A P27815 6/20 0.54
PDE4B Q07343 6/20 0.54
PDE4C Q08493 6/20 0.54
PDE4D Q08499 6/20 0.54
FBP1 P09467 1/20 0.42
KCNH2 Q12809 1/20 0.35
GPR119 Q8TDV5 1/20 0.34
MAPT P10636 2/20 0.33
BRD4 O60885 1/20 0.33
GALR3 O60755 1/20 0.33
THRB P10828 1/20 0.33

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
SCHEMBL3440910 0.84 PDE3B (0.62) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7271444 0.82 PDE3B (0.52) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL8199834 0.82 PDE3B (0.52) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL6866194 0.82 PDE3B (0.53) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL13864400 0.81 PDE3B (0.55) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7343569 0.77 PDE3B (0.48) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7323199 0.77 FBP1 (0.52) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL3440851 0.76 MAPT (0.64) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7295733 0.73 PDE3B (0.52) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7432080 0.73 PDE3B (0.52) PDE3BPDE3APDE4APDE4BPDE4C

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
EP-1341539-B1 ANTI-INFLAMMATORY AGENTS ORION CORP (FI) 2005-05-04 EP disclosed
US-6878702-B2 Anti-inflammatory agents ORION CORPORATION (FI) 2005-04-12 US disclosed
US-20040029870-A1 Anti-inflammatory agents ORION CORPORATION (FI) 2004-02-12 US disclosed
EP-1341539-A1 ANTI-INFLAMMATORY AGENTS ORION CORPORATION (FI) 2003-09-10 EP disclosed
WO-2002040025-A1 ANTI-INFLAMMATORY AGENTS ORION CORPORATION (FI) 2002-05-23 WO disclosed
US-5246928-A Cardiovascular disorders SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1993-09-21 US disclosed
US-5185332-A Treating congestive heart failure ORION-YHTYMA OY (FI) 1993-02-09 US disclosed
US-5066653-A Cardiovascular disorders; bronchodilators; phosphodiesterase inhibitors SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1991-11-19 US disclosed
US-4906628-A N-phenylpyridone type III phosphodiesterases SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1990-03-06 US disclosed
EP-0220044-A2 4(4-oxo-1,4-dihydropyridin-1-yl)phenyl derivatives SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1987-04-29 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-20040029870-A1 Anti-inflammatory agents AIFM1, PTGS1, CASP1 PDE3B 1050/4885PDE3A 1298/4885PDE4A 1135/4885

“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.