SCHEMBL4900091

SCHEMBL4900091

COc1cc(OC)cc(C(=O)Nc2cccc(Nc3nccc(-c4ccccn4)n3)c2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
ABL1 P00519 10/20 0.58
BCR P11274 10/20 0.58
PRKCA P17252 6/20 0.58
PDGFRB P09619 6/20 0.58
PDGFRA P16234 6/20 0.58
SRC P12931 4/20 0.58
PRKCD Q05655 3/20 0.58
PRKD3 O94806 1/20 0.58
PRKCG P05129 1/20 0.58
PRKCB P05771 1/20 0.58
PRKCH P24723 1/20 0.58
PRKCI P41743 1/20 0.58
PRKCE Q02156 1/20 0.58
PRKCQ Q04759 1/20 0.58
PRKCZ Q05513 1/20 0.58
PRKD1 Q15139 1/20 0.58
JAK2 O60674 1/20 0.58
EGFR P00533 1/20 0.55

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
SCHEMBL4899553 0.92 ABL1 (0.61) MEN1KMT2AABL1BCRPRKCA
SCHEMBL4901565 0.92 MEN1 (0.59) MEN1KMT2APRKCAJAK2CASP3
SCHEMBL6041113 0.89 ABL1 (0.57) MEN1KMT2AABL1BCRPRKCA
SCHEMBL3123402 0.87 ABL1 (0.74) ABL1BCRPRKCAPDGFRBPDGFRA
SCHEMBL4905315 0.87 PDGFRA (0.61) ABL1BCRPRKCAPDGFRBPDGFRA
SCHEMBL4905073 0.86 ABL1 (0.67) ABL1BCRPRKCAPDGFRBPDGFRA
SCHEMBL4906046 0.85 ABL1 (0.76) ABL1BCRPRKCAPDGFRBPDGFRA
SCHEMBL4899247 0.85 ABL1 (0.73) ABL1BCRPRKCAPDGFRBPDGFRA
SCHEMBL4903283 0.85 ABL1 (0.61) ABL1BCRPRKCAPDGFRBPDGFRA
SCHEMBL4901723 0.82 ABL1 (0.64) ABL1BCRPRKCAPDGFRBPDGFRA

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
EP-1721609-A2 Pyridylpyrimidine derivatives as effective compounds against prion infections and prion diseases GPC Biotech AG (DE) 2006-11-15 EP claimed
US-20060217404-A1 Pyridylpyrimidine derivatives as effective compounds against prion infections and prion diseases GPC BIOTECH FORSCHUNGSGESELLSCHAFT MBH (DE) 2006-09-28 US claimed
EP-1395261-B1 PYRIDYLPYRIMIDINE DERIVATIVES AS EFFECTIVE COMPOUNDS AGAINST PRION DISEASES GPC BIOTECH AG (DE) 2006-06-28 EP claimed
US-20030176443-A1 Pyridylpyrimidine derivatives as effective compounds against prion diseases GPC BIOTECH FORSCHUNGSGESELLSCHAFT MBH (DE) 2003-09-18 US claimed
US-20080187575-A1 Pyrimidine Derivatives VICHEM CHEMIE KFT (HU) 2008-08-07 US disclosed
EP-1786781-A2 PYRIMIDINE DERIVATIVES GPC Biotech AG (DE) 2007-05-23 EP disclosed
EP-1721609-A2 Pyridylpyrimidine derivatives as effective compounds against prion infections and prion diseases GPC Biotech AG (DE) 2006-11-15 EP disclosed
US-20060217404-A1 Pyridylpyrimidine derivatives as effective compounds against prion infections and prion diseases GPC BIOTECH FORSCHUNGSGESELLSCHAFT MBH (DE) 2006-09-28 US disclosed
EP-1395261-B1 PYRIDYLPYRIMIDINE DERIVATIVES AS EFFECTIVE COMPOUNDS AGAINST PRION DISEASES GPC BIOTECH AG (DE) 2006-06-28 EP disclosed
WO-2006021458-A2 PYRIMIDINE DERIVATIVES GPC BIOTECH AG (DE) 2006-03-02 WO disclosed
US-20030176443-A1 Pyridylpyrimidine derivatives as effective compounds against prion diseases GPC BIOTECH FORSCHUNGSGESELLSCHAFT MBH (DE) 2003-09-18 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 (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-20030176443-A1 Pyridylpyrimidine derivatives as effective compounds against prion diseases PRNP, PPM1D, PPM1F MEN1 4149/4885KMT2A 2560/4885ABL1 901/4885
US-20060217404-A1 Pyridylpyrimidine derivatives as effective compounds against prion infections and prion diseases PRNP, PPM1D, PPM1F MEN1 4219/4885KMT2A 2319/4885ABL1 904/4885
US-20080187575-A1 Pyrimidine Derivatives TYMP, TDP1, PNP MEN1 3644/4885KMT2A 3738/4885ABL1 2843/4885

“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.