SCHEMBL4495262

SCHEMBL4495262

CCN(CC)C(=O)c1ccc(Oc2nc(Nc3ccc(OCCN4CCN(C(C)C)CC4)c(F)c3)ncc2C(=O)Nc2c(C)cccc2C)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LCK P06239 4/20 0.43
TNK2 Q07912 4/20 0.43
BTK Q06187 3/20 0.43
JAK3 P52333 2/20 0.43
KDR P35968 4/20 0.40
SRC P12931 4/20 0.40
MET P08581 6/20 0.39
SIK1 P57059 2/20 0.39
SIK2 Q9H0K1 2/20 0.39
SIK3 Q9Y2K2 2/20 0.39
INSR P06213 1/20 0.38
MAPK14 Q16539 1/20 0.37
FGFR1 P11362 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
SCHEMBL5686268 0.94 LCK (0.45) LCKTNK2BTKJAK3KDR
SCHEMBL4497734 0.93 LCK (0.45) LCKTNK2BTKJAK3KDR
SCHEMBL4496586 0.91 SRC (0.46) LCKTNK2BTKJAK3KDR
SCHEMBL4488342 0.91 NTRK1 (0.45) LCKTNK2BTKJAK3KDR
SCHEMBL4507483 0.90 TNK2 (0.43) LCKTNK2BTKJAK3KDR
SCHEMBL4506311 0.90 TNK2 (0.47) LCKTNK2BTKJAK3KDR
SCHEMBL4487763 0.89 MET (0.42) LCKTNK2BTKJAK3KDR
SCHEMBL4487717 0.88 SIK1 (0.44) LCKTNK2BTKJAK3KDR
SCHEMBL4481283 0.88 BTK (0.42) LCKTNK2BTKJAK3KDR
SCHEMBL4496045 0.87 LCK (0.48) LCKTNK2BTKJAK3KDR

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 7 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
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 disclosed
US-20050209221-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2005-09-22 US disclosed
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 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 LCK 33/4885TNK2 1854/4885BTK 1420/4885

“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.