Hydrogen Sulfide

Hydrogen Sulfide

SCHEMBL2479876

Cc1cc(SC2CCN(C(=O)OC(C)(C)C)CC2)cc2c(Nc3ccc4ncn(C)c4c3)c(C(N)=O)cnc12.S

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 6/20 0.38
SYK P43405 2/20 0.37
GCK P35557 1/20 0.37
KEAP1 Q14145 2/20 0.36
NFE2L2 Q16236 2/20 0.36
CSF1R P07333 4/20 0.36
SLC2A1 P11166 1/20 0.35
NR3C1 P04150 1/20 0.35
EGFR P00533 1/20 0.34
PDE4A P27815 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
PARP1 P09874 1/20 0.34
PIK3CA P42336 1/20 0.34
MTOR P42345 1/20 0.34
PRKDC P78527 1/20 0.34

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
SCHEMBL2478982 0.86 PDE4B (0.45) PDE4BSYKCSF1RPIK3CA
SCHEMBL5321961 0.83 CSF1R (0.46) PDE4BGCKCSF1RSLC2A1NR3C1
SCHEMBL2479148 0.83 PDE4B (0.58) PDE4BCSF1R
SCHEMBL13593041 0.74 PDE4B (0.48) PDE4BSYKCSF1R
SCHEMBL5321963 0.73 CSF1R (0.44) PDE4BCSF1RSLC2A1EGFRPDE4A
SCHEMBL5960601 0.73 PDE4B (0.56) PDE4BCSF1R
SCHEMBL4426168 0.72 PDE4B (0.42) PDE4BSYKCSF1R
SCHEMBL1276146 0.71 PDE4B (0.42) PDE4BCSF1R
SCHEMBL5318637 0.70 PDE4B (0.50) PDE4BCSF1R
SCHEMBL2482718 0.70 PDE4B (0.66) PDE4BCSF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1944305-B1 Quinoline derivatives as phosphodiesterase inhibitors GLAXO GROUP LTD (GB) 2011-10-19 EP disclosed
US-20090312325-A1 Quinoline Derivatives As Phosphodiesterase Inhibitors BALDWIN IAN ROBERT 2009-12-17 US disclosed
US-7572915-B2 4-[(3-methylphenyl)amino]-6-(methylsulfonyl)-3-quinolinecarboxamide; asthma, COPD, allergic rhinitis, or rheumatoid arthritis in a human GLAXO GROUP LIMITED (GB) 2009-08-11 US disclosed
US-7566786-B2 Quinoline derivatives as phosphodiesterase inhibitors GLAXO GROUP LIMITED (GB) 2009-07-28 US disclosed
EP-1633748-B1 QUINOLINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LTD (GB) 2008-03-05 EP disclosed
US-20070142373-A1 Quinoline derivatives as phosphodiesterase inhibitors GLAXO GROUP LIMITED (GB) 2007-06-21 US disclosed
US-20070049570-A1 Quinoline derivatives as phosphodiesterase inhibitors DEAN ANTHONY W 2007-03-01 US disclosed
US-20060178416-A1 Quinoline derivatives as phosphodiesterase inhibitors BARKER MICHAEL D 2006-08-10 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 (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-20060178416-A1 Quinoline derivatives as phosphodiesterase inhibitors PDE3B, PDE4B, PDE4A PDE4B 2/4885SYK 1326/4885GCK 3618/4885
US-20090312325-A1 Quinoline Derivatives As Phosphodiesterase Inhibitors PDE3B, PDE4B, PDE4A PDE4B 2/4885SYK 1326/4885GCK 3618/4885
US-20070049570-A1 Quinoline derivatives as phosphodiesterase inhibitors PDE3B, PDE4B, PDE4A PDE4B 2/4885SYK 1326/4885GCK 3618/4885
US-20070142373-A1 Quinoline derivatives as phosphodiesterase inhibitors PDE3B, PDE4B, PDE4A PDE4B 2/4885SYK 1326/4885GCK 3618/4885

“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.