SCHEMBL4805030

SCHEMBL4805030

CCS(=O)(=O)c1ccc(OC)c(Nc2nccc(N(C)c3ccc(NC(=O)Nc4cccc(Cl)c4)cc3)n2)c1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDR P35968 18/20 0.55
RIPK1 Q13546 2/20 0.51
MLKL Q8NB16 2/20 0.51
RIPK3 Q9Y572 2/20 0.51
AURKA O14965 1/20 0.51
ABL1 P00519 1/20 0.47
BCR P11274 1/20 0.47

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
SCHEMBL4805956 0.91 KDR (0.55) KDRRIPK1MLKLRIPK3AURKA
SCHEMBL4811712 0.85 KDR (0.46) KDRRIPK1MLKLRIPK3AURKA
SCHEMBL4814935 0.83 KDR (0.72) KDRRIPK1MLKLRIPK3AURKA
SCHEMBL4815595 0.81 KDR (0.75) KDRRIPK1MLKLRIPK3AURKA
SCHEMBL4809268 0.79 KDR (0.85) KDRRIPK1MLKLRIPK3AURKA
SCHEMBL4815066 0.77 KDR (0.46) KDRRIPK1MLKLRIPK3AURKA
SCHEMBL4813443 0.77 KDR (0.71) KDRRIPK1MLKLRIPK3AURKA
SCHEMBL4811371 0.74 KDR (0.72) KDRRIPK1MLKLRIPK3AURKA
SCHEMBL4811907 0.73 KDR (0.75) KDRRIPK1MLKLRIPK3AURKA
SCHEMBL4812736 0.73 KDR (0.52) KDRRIPK1MLKLRIPK3AURKA

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
WO-2023196714-A9 INHIBITORS OF DDR1 AND DDR2 FOR THE TREATMENT OF ARTHRITIS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-11-23 WO disclosed
WO-2023196714-A2 INHIBITORS OF DDR1 AND DDR2 FOR THE TREATMENT OF ARTHRITIS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-10-12 WO disclosed
US-7459455-B2 Pyrimidine compounds SMITHKLINE BEECHAM CORPORATION (US) 2008-12-02 US disclosed
US-7459455-B2 Pyrimidine compounds SMITHKLINE BEECHAM CORPORATION (US) 2008-12-02 US disclosed
US-7459455-B2 Pyrimidine compounds SMITHKLINE BEECHAM CORPORATION (US) 2008-12-02 US disclosed
US-20050085637-A1 Antiproliferative agents; angiogenesis inhibitors SMITHKLINE BEECHAM CORPORATION 2005-04-21 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-20050085637-A1 Antiproliferative agents; angiogenesis inhibitors TIE1, TEK, KDR KDR 3/4885RIPK1 2377/4885MLKL 1727/4885

“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.