SCHEMBL4897200

SCHEMBL4897200

Cc1ccc(NC(=O)CCl)cc1Nc1nccc(-c2cccnc2)n1

nearest known ligand 0.88

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 10/20 0.88
KIT P10721 5/20 0.88
ABL1 P00519 14/20 0.80
BCR P11274 11/20 0.80
PDGFRB P09619 5/20 0.80
EGFR P00533 2/20 0.74
PRKCA P17252 2/20 0.74
JAK3 P52333 1/20 0.74
BTK Q06187 1/20 0.74
ITK Q08881 1/20 0.74
KDR P35968 1/20 0.71

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
SCHEMBL11927813 0.94 PDGFRA (1.00) PDGFRAKITABL1BCRPDGFRB
SCHEMBL6265756 0.92 ABL1 (0.80) PDGFRAKITABL1BCRPDGFRB
SCHEMBL23246300 0.90 ABL1 (0.86) PDGFRAKITABL1BCRPDGFRB
SCHEMBL19556857 0.89 ABL1 (1.00) PDGFRAKITABL1BCRPDGFRB
Cyclohexane SCHEMBL5776157 0.87 ABL1 (0.81) PDGFRAKITABL1BCRPDGFRB
SCHEMBL723757 0.86 PDGFRA (1.00) PDGFRAKITABL1BCRPDGFRB
SCHEMBL4903441 0.86 PDGFRA (0.69) PDGFRAKITABL1BCRPDGFRB
SCHEMBL28677768 0.86 ABL1 (0.83) PDGFRAKITABL1BCRPDGFRB
SCHEMBL19556647 0.86 ABL1 (0.80) PDGFRAKITABL1BCRPDGFRB
SCHEMBL2004455 0.86 PDGFRA (0.91) PDGFRAKITABL1BCRPDGFRB

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 373/4885KIT 969/4885ABL1 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.