SCHEMBL4979259

SCHEMBL4979259

Cc1cc(C)cc(CC(=O)Nc2nc3ccccc3n2CNCc2ccnc(Nc3ccc(CS(C)(=O)=O)cc3)n2)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.42
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
SLC2A1 P11166 1/20 0.39
RORC P51449 1/20 0.38
MET P08581 2/20 0.37
IKBKB O14920 1/20 0.37
MEN1 O00255 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
PTK2 Q05397 1/20 0.36
ROCK2 O75116 2/20 0.36
OPRK1 P41145 1/20 0.36
NTRK1 P04629 1/20 0.36
NTRK2 Q16620 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
NOD2 Q9HC29 1/20 0.36

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
SCHEMBL4977121 0.93 KDR (0.47) KDRLMNASMN1; SMN2NPSR1SLC2A1
SCHEMBL4980906 0.91 KDR (0.42) KDRLMNASLC2A1METIKBKB
SCHEMBL4978451 0.91 KDM4E (0.45) KDRLMNASMN1; SMN2NPSR1MET
SCHEMBL4978436 0.90 ROCK2 (0.43) KDRLMNASMN1; SMN2NPSR1SLC2A1
SCHEMBL4980382 0.89 KDR (0.43) KDRLMNASMN1; SMN2SLC2A1MET
SCHEMBL4978588 0.89 KDR (0.43) KDRSLC2A1RORCMETROCK2
SCHEMBL4978778 0.88 SLC2A1 (0.43) KDRLMNASMN1; SMN2NPSR1SLC2A1
SCHEMBL4978076 0.88 NOD1 (0.44) KDRLMNASMN1; SMN2NPSR1SLC2A1
SCHEMBL4976665 0.88 KDR (0.38) KDRLMNASMN1; SMN2NPSR1SLC2A1
SCHEMBL6635296 0.88 HTT (0.45) KDRLMNASMN1; SMN2SLC2A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7338959-B2 Diamino-pyrimidines and their use as angiogenesis inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2008-03-04 US claimed
US-20050234083-A1 Diamino-pyrimidines and their use as angiogenesis inhibitors SMITHKLINE BEECHAM CORPORATION 2005-10-20 US claimed
US-7338959-B2 Diamino-pyrimidines and their use as angiogenesis inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2008-03-04 US disclosed
US-20050234083-A1 Diamino-pyrimidines and their use as angiogenesis inhibitors SMITHKLINE BEECHAM CORPORATION 2005-10-20 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 (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-20050234083-A1 Diamino-pyrimidines and their use as angiogenesis inhibitors TIE1, TEK, KDR KDR 3/4885LMNA 3917/4885SMN1; SMN2 3839/4885

“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.