SCHEMBL4044184

SCHEMBL4044184

C1CCC1.CCC(c1nc2onc(C)c2c(=O)n1Cc1ccccc1)N(CCCN)C(=O)O

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 20/20 0.79

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
SCHEMBL4038069 0.90 KIF11 (0.92) KIF11
SCHEMBL4038230 0.90 KIF11 (0.79) KIF11
SCHEMBL4038208 0.89 KIF11 (0.76) KIF11
SCHEMBL3871453 0.88 KIF11 (1.00) KIF11
SCHEMBL4037728 0.88 KIF11 (0.75) KIF11
SCHEMBL4040590 0.88 KIF11 (0.80) KIF11
SCHEMBL4042044 0.88 KIF11 (0.91) KIF11
SCHEMBL3873980 0.88 KIF11 (1.00) KIF11
SCHEMBL3872670 0.88 KIF11 (1.00) KIF11
SCHEMBL4044656 0.87 KIF11 (0.87) KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7569572-B2 Pyrazolo[4,3-D]pyrimidines PFIZER INC (US) 2009-08-04 US disclosed
EP-1620437-B1 5,7-DIAMINOPYRAZOLO¬4,3-D PYRIMIDINES USEFUL IN THE TRAETMENT OF HYPERTENSION PFIZER LTD (GB) 2009-06-17 EP disclosed
EP-1742950-B1 PYRAZOLO[4,3-D] PYRIMIDINES PFIZER LTD (GB) 2008-12-17 EP disclosed
US-20080293697-A1 Pyrazolo[4,3-D]Pyrimidines BELL ANDREW SIMON 2008-11-27 US disclosed
US-20070270412-A1 NOVEL PHARMACEUTICALS PFIZER INC 2007-11-22 US disclosed
US-7262192-B2 Substituted pyrazolo[4,3-d]pyrimidines and their use as PDE-5 inhibitors PFIZER INC. (US) 2007-08-28 US disclosed
EP-1742950-A1 PYRAZOLO[4,3-D] PYRIMIDINES Pfizer Limited (GB) 2007-01-17 EP disclosed
EP-1620437-A1 5,7-DIAMINOPYRAZOLO[4,3-D]PYRIMIDINES USEFUL IN THE TRAETMENT OF HYPERTENSION Pfizer Limited (GB) 2006-02-01 EP disclosed
WO-2005097799-A1 PYRAZOLO`4,3-D! PYRIMIDINES PFIZER LIMITED (GB) 2005-10-20 WO disclosed
US-20050043325-A1 Novel pharmaceuticals PFIZER INC 2005-02-24 US disclosed
WO-2004096810-A1 5,7-DIAMINOPYRAZOLO`4,3-D!PYRIMIDINES USEFUL IN THE TREATMENT OF HYPERTENSION PFIZER LIMITED (GB) 2004-11-11 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 (3 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-20080293697-A1 Pyrazolo[4,3-D]Pyrimidines DPYD, TYMS, TYMP KIF11 1445/4885
US-20050043325-A1 Novel pharmaceuticals ABCB11, PCSK9, SLC10A1 KIF11 2174/4885
US-20070270412-A1 NOVEL PHARMACEUTICALS ABCB11, PCSK9, SLC10A1 KIF11 2174/4885

“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.