SCHEMBL4978778

SCHEMBL4978778

CS(=O)(=O)Cc1ccc(Nc2nccc(CNCn3c(NC(=O)Cc4ccccc4F)nc4ccccc43)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.43
KDR P35968 7/20 0.39
ROCK2 O75116 5/20 0.39
MET P08581 2/20 0.38
RORC P51449 1/20 0.36
LMNA P02545 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
HTT P42858 1/20 0.36
HIF1A Q16665 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPSR1 Q6W5P4 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
SCHEMBL4980536 0.95 SLC2A1 (0.43) SLC2A1KDRROCK2MET
SCHEMBL4976599 0.93 SLC2A1 (0.41) SLC2A1KDRROCK2METKDM4E
SCHEMBL4980906 0.92 KDR (0.42) SLC2A1KDRROCK2METLMNA
SCHEMBL4978076 0.91 NOD1 (0.44) SLC2A1KDRROCK2LMNASMN1; SMN2
SCHEMBL4977121 0.91 KDR (0.47) SLC2A1KDRROCK2METLMNA
SCHEMBL4978588 0.89 KDR (0.43) SLC2A1KDRROCK2METRORC
SCHEMBL4978451 0.89 KDM4E (0.45) KDRROCK2METLMNASMN1; SMN2
SCHEMBL4979259 0.88 KDR (0.42) SLC2A1KDRROCK2METRORC
SCHEMBL6635296 0.88 HTT (0.45) SLC2A1KDRLMNASMN1; SMN2HTT
SCHEMBL4981233 0.87 KDM4E (0.41) SLC2A1KDRROCK2METLMNA

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-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
EP-1487824-A1 DIAMINO-PYRIMIDINES AND THEIR USE AS ANGIOGENESIS INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-12-22 EP disclosed
WO-2003074515-A1 DIAMINO-PYRIMIDINES AND THEIR USE AS ANGIOGENESIS INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-09-12 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-20050234083-A1 Diamino-pyrimidines and their use as angiogenesis inhibitors TIE1, TEK, KDR SLC2A1 2444/4885KDR 3/4885ROCK2 721/4885

“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.