SCHEMBL4905591

SCHEMBL4905591

O=C(Nc1ccc(Nc2nccc(-c3ccncc3)n2)cc1)c1ccc(CCl)cc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 8/20 0.64
ABL1 P00519 7/20 0.64
KIT P10721 4/20 0.64
CAMK2D Q13557 3/20 0.58
BCR P11274 4/20 0.54
SRC P12931 2/20 0.54
PRKCA P17252 1/20 0.54
PRKCD Q05655 1/20 0.54
JAK2 O60674 3/20 0.52
HDAC1 Q13547 1/20 0.52
MAPK8 P45983 1/20 0.51
MAPK10 P53779 1/20 0.51
JAK3 P52333 2/20 0.50
PDGFRB P09619 3/20 0.49
SYK P43405 1/20 0.49

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
SCHEMBL4903223 0.90 ABL1 (0.70) PDGFRAABL1KITCAMK2DBCR
SCHEMBL3863391 0.89 PDGFRA (0.78) PDGFRAABL1KITBCRSRC
SCHEMBL4905540 0.88 ABL1 (0.62) PDGFRAABL1CAMK2DBCRSRC
SCHEMBL4897327 0.85 CAMK2D (0.61) PDGFRAABL1CAMK2DBCRSRC
SCHEMBL4903404 0.85 JAK2 (0.68) PDGFRAABL1CAMK2DBCRSRC
SCHEMBL14021027 0.84 CAMK2D (0.67) PDGFRAABL1CAMK2DBCRSRC
SCHEMBL4901725 0.83 ABL1 (0.72) PDGFRAABL1KITBCRSRC
SCHEMBL13911480 0.83 CAMK2D (0.68) PDGFRAABL1CAMK2DBCRSRC
SCHEMBL4900802 0.83 CAMK2D (0.60) PDGFRAABL1KITCAMK2DBCR
SCHEMBL4892512 0.83 ABL1 (0.67) PDGFRAABL1KITCAMK2DBCR

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 PDGFRA 373/4885ABL1 2843/4885KIT 969/4885

“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.