SCHEMBL4897217

SCHEMBL4897217

O=C(CN1CCOCC1)Nc1cccc(Nc2nccc(-c3cccnc3)n2)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 15/20 0.68
BCR P11274 12/20 0.68
ABL2 P42684 2/20 0.66
SRC P12931 9/20 0.62
PDGFRB P09619 8/20 0.62
PDGFRA P16234 8/20 0.62
PRKCA P17252 4/20 0.62
PRKCD Q05655 4/20 0.62
PRKD3 O94806 1/20 0.60
PRKCG P05129 1/20 0.60
PRKCB P05771 1/20 0.60
PRKCH P24723 1/20 0.60
PRKCI P41743 1/20 0.60
PRKCE Q02156 1/20 0.60
PRKCQ Q04759 1/20 0.60
PRKCZ Q05513 1/20 0.60
PRKD1 Q15139 1/20 0.60
GSK3B P49841 2/20 0.59
DYRK1A Q13627 2/20 0.59
JAK3 P52333 2/20 0.58

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
SCHEMBL4902913 0.92 ABL1 (0.57) ABL1BCRABL2SRCPDGFRB
SCHEMBL4894465 0.89 ABL1 (0.73) ABL1BCRABL2SRCPDGFRB
SCHEMBL4894484 0.88 ABL1 (0.67) ABL1BCRABL2SRCPDGFRB
SCHEMBL8349109 0.87 JAK2 (0.61) ABL1BCRABL2SRCPRKD3
SCHEMBL4903833 0.86 SYK (0.57) ABL1BCRJAK3SYKJAK2
SCHEMBL4901605 0.84 ABL1 (0.62) ABL1BCRABL2SRCPDGFRB
SCHEMBL4382875 0.84 JAK2 (0.63) ABL1BCRSRCJAK3JAK2
SCHEMBL13924584 0.84 SYK (0.53) ABL1BCRABL2SRCPRKD3
SCHEMBL14348363 0.83 JAK2 (0.64) JAK3JAK2JAK1
SCHEMBL4901373 0.82 ABL1 (0.59) ABL1BCRABL2SRCPDGFRB

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-20080187575-A1 Pyrimidine Derivatives VICHEM CHEMIE KFT (HU) 2008-08-07 US claimed
EP-1786781-A2 PYRIMIDINE DERIVATIVES GPC Biotech AG (DE) 2007-05-23 EP claimed
WO-2006021458-A2 PYRIMIDINE DERIVATIVES GPC BIOTECH AG (DE) 2006-03-02 WO 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
WO-2006021458-A2 PYRIMIDINE DERIVATIVES GPC BIOTECH AG (DE) 2006-03-02 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-20080187575-A1 Pyrimidine Derivatives TYMP, TDP1, PNP ABL1 2843/4885BCR 2315/4885ABL2 2837/4885

“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.