SCHEMBL4040747

SCHEMBL4040747

CNC(=O)CCNC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.39
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
ECE1 P42892 2/20 0.37
MCL1 Q07820 1/20 0.36
KDM4E B2RXH2 1/20 0.34
KDM5C P41229 1/20 0.34
EGLN1 Q9GZT9 1/20 0.34
PHF8 Q9UPP1 1/20 0.34
KDM2A Q9Y2K7 1/20 0.34
ITGB3 P05106 1/20 0.34
ITGAV P06756 1/20 0.34
PRMT1 Q99873 1/20 0.33
NAMPT P43490 1/20 0.33
HDAC1 Q13547 1/20 0.33
ALDH1A1 P00352 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
FPR3 P25089 1/20 0.32

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
SCHEMBL18995822 0.82 NAMPT (0.49) KDM4EPRMT1NAMPTHDAC1ALDH1A1
SCHEMBL13853553 0.82 LMNA (0.48) LMNAPOLBECE1MCL1PRMT1
SCHEMBL12256113 0.80 KDM4E (0.50) LMNAPOLBMCL1KDM4EALDH1A1
SCHEMBL10055747 0.78 LMNA (0.44) LMNAPOLBECE1MCL1NAMPT
SCHEMBL9279644 0.78 MEN1 (0.58) LMNACYP2C19ECE1ALDH1A1MEN1
SCHEMBL14447772 0.78 LMNA (0.44) LMNAPOLBECE1MCL1NAMPT
SCHEMBL27368756 0.78 LMNA (0.44) LMNAPOLBECE1MCL1NAMPT
SCHEMBL23728846 0.76 CASP2 (0.47) MCL1ALDH1A1MEN1KMT2ACASP2
SCHEMBL12564384 0.76 LMNA (0.43) LMNAPOLBECE1MCL1HDAC1
SCHEMBL23367873 0.76 LMNA (0.43) LMNAPOLBECE1MCL1KDM4E

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
EP-1620437-B1 5,7-DIAMINOPYRAZOLO¬4,3-D PYRIMIDINES USEFUL IN THE TRAETMENT OF HYPERTENSION PFIZER LTD (GB) 2009-06-17 EP 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-1620437-A1 5,7-DIAMINOPYRAZOLO[4,3-D]PYRIMIDINES USEFUL IN THE TRAETMENT OF HYPERTENSION Pfizer Limited (GB) 2006-02-01 EP 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 (2 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-20050043325-A1 Novel pharmaceuticals ABCB11, PCSK9, SLC10A1 LMNA 4275/4885POLB 4781/4885CYP2D6 26/4885
US-20070270412-A1 NOVEL PHARMACEUTICALS ABCB11, PCSK9, SLC10A1 LMNA 4275/4885POLB 4781/4885CYP2D6 26/4885

“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.