SCHEMBL1178582

SCHEMBL1178582

O=P(O)(O)OCCn1cc(-c2cnc3nnn(Cc4ccc5ncccc5c4)c3n2)cn1

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MET P08581 20/20 0.77
CYP2C9 P11712 1/20 0.77
PDE3B Q13370 1/20 0.77
PDE3A Q14432 1/20 0.77
PDE10A Q9Y233 1/20 0.77

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
Pf-04217903 SCHEMBL1178576 0.90 MET (0.92) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL2570505 0.90 MET (0.80) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL16366038 0.88 MET (0.80) METCYP2C9PDE3BPDE3APDE10A
Pf-04217903 SCHEMBL29355971 0.87 MET (1.00) METCYP2C9PDE3BPDE3APDE10A
Pf-04217903 SCHEMBL93550 0.87 MET (1.00) METCYP2C9PDE3BPDE3APDE10A
Pf-04217903 SCHEMBL29394198 0.87 MET (1.00) METCYP2C9PDE3BPDE3APDE10A
Pf-04217903 SCHEMBL1178807 0.86 MET (0.98) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL2571583 0.86 MET (0.74) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL29528188 0.86 MET (0.74) METCYP2C9PDE3BPDE3APDE10A
SCHEMBL2572767 0.85 MET (0.84) METCYP2C9PDE3BPDE3APDE10A

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-20110039856-A1 POLYMORPHS OF A C-MET/HGFR INHIBITOR PFIZER INC. 2011-02-17 US claimed
EP-2227473-A2 POLYMORPHS OF A C-MET/HGFR INHIBITOR Pfizer Inc. (US) 2010-09-15 EP claimed
WO-2009068955-A2 POLYMORPHS OF A C-MET/HGFR INHIBITOR PFIZER INC. (US) 2009-06-04 WO claimed
US-20110039856-A1 POLYMORPHS OF A C-MET/HGFR INHIBITOR PFIZER INC. 2011-02-17 US disclosed
EP-2227473-A2 POLYMORPHS OF A C-MET/HGFR INHIBITOR Pfizer Inc. (US) 2010-09-15 EP disclosed
WO-2009068955-A2 POLYMORPHS OF A C-MET/HGFR INHIBITOR PFIZER INC. (US) 2009-06-04 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-20110039856-A1 POLYMORPHS OF A C-MET/HGFR INHIBITOR MET, HGF, KRAS MET 1/4885CYP2C9 2267/4885PDE3B 4134/4885

“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.