SCHEMBL4144624

SCHEMBL4144624

O=C1Nc2cc(C(=O)O)ccc2C1=Cc1ccc[nH]1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 5/20 0.81
TLK2 Q86UE8 5/20 0.81
JAK3 P52333 5/20 0.81
PDGFRB P09619 5/20 0.67
FLT3 P36888 4/20 0.65
KIT P10721 2/20 0.65
FLT4 P35916 2/20 0.65
KDR P35968 5/20 0.65
AURKB Q96GD4 4/20 0.65
RET P07949 3/20 0.65
NTRK1 P04629 3/20 0.65
CHEK1 O14757 2/20 0.65
DAPK3 O43293 2/20 0.65
MAP4K4 O95819 2/20 0.65
LCK P06239 2/20 0.65
CSF1R P07333 2/20 0.65
FGFR1 P11362 2/20 0.65
FLT1 P17948 2/20 0.65
LTK P29376 2/20 0.65
RPS6KA3 P51812 2/20 0.65

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
SCHEMBL4144620 1.00 PDPK1 (0.81) PDPK1TLK2JAK3PDGFRBFLT3
SCHEMBL20944 0.90 TLK2 (1.00) PDPK1TLK2JAK3PDGFRBFLT3
SCHEMBL20945 0.90 TLK2 (1.00) PDPK1TLK2JAK3PDGFRBFLT3
SCHEMBL5728570 0.83 PDPK1 (1.00) PDPK1TLK2JAK3PDGFRBFLT3
SCHEMBL5728571 0.83 PDPK1 (1.00) PDPK1TLK2JAK3PDGFRBFLT3
SCHEMBL394103 0.81 NTRK1 (0.85) TLK2JAK3PDGFRBFLT3KIT
SCHEMBL10091844 0.81 NTRK1 (0.85) TLK2JAK3PDGFRBFLT3KIT
SCHEMBL5728440 0.81 PDPK1 (1.00) PDPK1TLK2JAK3PDGFRBFLT3
SCHEMBL5728434 0.81 PDPK1 (1.00) PDPK1TLK2JAK3PDGFRBFLT3
SCHEMBL397847 0.80 NTRK1 (0.89) TLK2JAK3PDGFRBFLT3KIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1814545-A4 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-06-10 EP claimed
US-20080221192-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2008-09-11 US claimed
EP-1814545-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM, LLC (BM) 2007-08-08 EP claimed
WO-2006052936-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-05-18 WO claimed
US-20050090541-A1 Indolinone derivatives and their use in treating disease-states such as cancer SCHERING AKTIENGESELLSCHAFT (DE) 2005-04-28 US claimed
CN-101056632-B Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2011-12-07 CN disclosed
EP-1814545-A4 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-06-10 EP disclosed
US-20080221192-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2008-09-11 US disclosed
EP-1814545-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM, LLC (BM) 2007-08-08 EP disclosed
US-7105563-B2 Indolinone derivatives and their use in treating disease-states such as cancer SCHERING AKTIENGESELLSCHAFT (DE) 2006-09-12 US disclosed
EP-1680401-A2 INDOLINONE DERIVATIVES AND THEIR USE IN TREATING DISEASE-STATES SUCH AS CANCER Schering Aktiengesellschaft (DE) 2006-07-19 EP disclosed
WO-2006052936-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-05-18 WO disclosed
WO-2005040116-A2 INDOLINONE DERIVATIVES AND THEIR USE IN TREATING DISEASE-STATES SUCH AS CANCER SCHERING AKTIENGESELLSCHAFT (DE) 2005-05-06 WO disclosed
US-20050090541-A1 Indolinone derivatives and their use in treating disease-states such as cancer SCHERING AKTIENGESELLSCHAFT (DE) 2005-04-28 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-20050090541-A1 Indolinone derivatives and their use in treating disease-states such as cancer PDK3, PDK2, PDK4 PDPK1 4/4885TLK2 847/4885JAK3 2537/4885
US-20080221192-A1 Compounds and Compositions as Protein Kinase Inhibitors BMX, FRK, PTK2B PDPK1 370/4885TLK2 181/4885JAK3 261/4885

“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.