SCHEMBL5228870

SCHEMBL5228870

CCOC(=O)c1cn(-c2ccc(/C=C/c3cscn3)cc2)nc1N(C(=O)[C@H]1CC[C@H](C)CC1)C1CCOCC1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.34
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
DRD4 P21917 1/20 0.30

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
SCHEMBL5228878 1.00 PDE4B (0.34) PDE4BMAPK1NPSR1DRD4
SCHEMBL14459849 1.00 PDE4B (0.34) PDE4BMAPK1NPSR1DRD4
SCHEMBL5233603 0.90 KDM4E (0.32)
SCHEMBL5232291 0.90 KDM4E (0.32)
SCHEMBL5232281 0.90 KDM4E (0.32)
SCHEMBL5232271 0.90 KDM4E (0.32)
SCHEMBL5235869 0.88 NPSR1 (0.38) PDE4BMAPK1NPSR1DRD4
SCHEMBL5235862 0.88 NPSR1 (0.38) PDE4BMAPK1NPSR1DRD4
SCHEMBL14459848 0.88 NPSR1 (0.38) PDE4BMAPK1NPSR1DRD4
SCHEMBL5232634 0.86 PDE4B (0.37) PDE4BMAPK1NPSR1DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1730116-B1 4-CARBOX PYRAZOLE DERIVATES USEFUL AS ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORP (US) 2007-09-05 EP disclosed
US-20070167507-A1 4-Carbox pyrazole derivatives useful as anti-viral agents GLAXO GROUP LIMITED (GB) 2007-07-19 US disclosed
EP-1730116-A1 4-CARBOX PYRAZOLE DERIVATES USEFUL AS ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2006-12-13 EP disclosed
WO-2005092863-A1 4-CARBOX PYRAZOLE DERIVATES USEFUL AS ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2005-10-06 WO 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-20070167507-A1 4-Carbox pyrazole derivatives useful as anti-viral agents HAVCR2, RPL35, ZC3HAV1L PDE4B 3416/4885MAPK1 3485/4885NPSR1 3202/4885

“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.