SCHEMBL4500423

SCHEMBL4500423

COCCNC(=O)c1ccc(Oc2nc(Nc3cc(OC)c(OC)c(OCCCN4CCN(C)CC4)c3)ncc2C(=O)Nc2c(C)cccc2C)c(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 7/20 0.45
TBK1 Q9UHD2 1/20 0.44
LCK P06239 8/20 0.43
SRC P12931 7/20 0.43
KDR P35968 6/20 0.43
JAK3 P52333 4/20 0.43
BTK Q06187 4/20 0.43
MAPK14 Q16539 4/20 0.43
MET P08581 2/20 0.43
JAK2 O60674 1/20 0.43
FGFR1 P11362 1/20 0.43
ZAP70 P43403 1/20 0.43
SYK P43405 1/20 0.43
TEK Q02763 1/20 0.43
TNK2 Q07912 1/20 0.41

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
SCHEMBL5686198 0.96 PTK2 (0.44) PTK2TBK1LCKSRCKDR
SCHEMBL4482664 0.94 PTK2 (0.46) PTK2TBK1LCKSRCKDR
SCHEMBL4510469 0.92 TBK1 (0.44) PTK2TBK1LCKSRCKDR
SCHEMBL4497538 0.91 PTK2 (0.47) PTK2TBK1LCK
SCHEMBL4488652 0.90 TBK1 (0.44) PTK2TBK1LCKSRCKDR
SCHEMBL5686155 0.90 PTK2 (0.46) PTK2TBK1LCKSRCKDR
SCHEMBL4495381 0.90 TBK1 (0.44) TBK1LCKSRCKDRJAK3
SCHEMBL4487526 0.90 LCK (0.47) PTK2LCKSRCKDRJAK3
SCHEMBL4500302 0.87 TBK1 (0.44) PTK2TBK1LCKSRCKDR
SCHEMBL4506463 0.87 LCK (0.52) PTK2TBK1LCKSRCKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1648464-A1 2-AMINO-4-HYDROXY-5-PYRIMIDINCARBOXAMID DERIVATIVES AND RELATED COMPOUNDS AS T-CELL ACTIVATION INHIBITORS FOR THE TREATMENT OF INFLAMMATIONS AMGEN INC. (US) 2006-04-26 EP claimed
US-20050209221-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2005-09-22 US claimed
WO-2005009443-A1 2-AMINO-4-HYDROXY-5-PYRIMIDINECARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF T CELL ACTIVATION FOR THE TREATMENT OF INFLAMMATORY DISEASES AMGEN INC. (US) 2005-02-03 WO claimed
US-7504396-B2 Substituted heterocyclic compounds and methods of use AMGEN INC. (US) 2009-03-17 US disclosed
US-20050209221-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2005-09-22 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-20050209221-A1 Substituted heterocyclic compounds and methods of use ICOS, CD4, HLA-DRB1 PTK2 1310/4885TBK1 3444/4885LCK 33/4885

“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.