SCHEMBL3065290

SCHEMBL3065290

[2H]C([2H])(Cl)c1ccc(C(=O)Nc2ccc(C)c(Nc3nccc(-c4cccnc4)n3)c2)cc1

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 13/20 0.89
ABL1 P00519 13/20 0.89
KIT P10721 9/20 0.89
BCR P11274 10/20 0.81
PDGFRB P09619 5/20 0.81
EGFR P00533 2/20 0.79
PRKCA P17252 1/20 0.79
KDR P35968 2/20 0.76
PLK4 O00444 1/20 0.76
DDX3X O00571 1/20 0.76
GAK O14976 1/20 0.76
SLC22A2 O15244 1/20 0.76
MAPK13 O15264 1/20 0.76
CA12 O43570 1/20 0.76
SLC22A3 O75751 1/20 0.76
ABCB11 O95342 1/20 0.76
CA1 P00915 1/20 0.76
CA2 P00918 1/20 0.76
LMNA P02545 1/20 0.76
ALB P02768 1/20 0.76

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
SCHEMBL3071844 0.95 PDGFRA (0.80) PDGFRAABL1KITBCRPDGFRB
SCHEMBL723757 0.94 PDGFRA (1.00) PDGFRAABL1KITBCRPDGFRB
Hydrochloric Acid SCHEMBL4396677 0.93 PDGFRA (0.98) PDGFRAABL1KITBCRPDGFRB
SCHEMBL27804782 0.91 PDGFRA (0.85) PDGFRAABL1KITBCRPDGFRB
SCHEMBL805395 0.91 PDGFRA (0.85) PDGFRAABL1KITBCRPDGFRB
SCHEMBL25281830 0.90 PDGFRA (1.00) PDGFRAABL1KITBCRPDGFRB
SCHEMBL14292529 0.90 PDGFRA (0.84) PDGFRAABL1KITBCRPDGFRB
SCHEMBL29628979 0.90 PDGFRA (1.00) PDGFRAABL1KITBCRPDGFRB
SCHEMBL21248036 0.90 PDGFRA (0.84) PDGFRAABL1KITBCRPDGFRB
SCHEMBL11927813 0.90 PDGFRA (1.00) PDGFRAABL1KITBCRPDGFRB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130121963-A1 N-PHENYL-2-PYRIMIDINEAMINE DERIVATIVES CONCERT PHARMACEUTICALS INC. (US) 2013-05-16 US disclosed
US-20100221221-A1 N-PHENYL-2-PYRIMIDINEAMINE DERIVATIVES CONCERT PHARMACEUTICALS INC. (US) 2010-09-02 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 (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-20130121963-A1 N-PHENYL-2-PYRIMIDINEAMINE DERIVATIVES NME2, NME1, ABL1 PDGFRA 158/4885ABL1 3/4885KIT 1603/4885
US-20100221221-A1 N-PHENYL-2-PYRIMIDINEAMINE DERIVATIVES NME2, NME1, ABL1 PDGFRA 158/4885ABL1 3/4885KIT 1603/4885

“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.