SCHEMBL4559339

SCHEMBL4559339

Cc1cccc(C)c1NC(=O)c1cnc(Nc2ccc(N3CCN(CCN(C)C)CC3)cc2)nc1Nc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SRC P12931 11/20 0.60
HCK P08631 1/20 0.57
FGFR1 P11362 1/20 0.57
LCK P06239 1/20 0.53
JAK3 P52333 1/20 0.53
BTK Q06187 1/20 0.53
TNK2 Q07912 1/20 0.53
BRD4 O60885 4/20 0.50
SYK P43405 1/20 0.49
STAT6 P42226 1/20 0.48
CDK4 P11802 1/20 0.48
CCND1 P24385 1/20 0.48

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
SCHEMBL4560051 0.95 SRC (0.58) SRCHCKFGFR1LCKJAK3
SCHEMBL4493726 0.85 LCK (0.49) SRCLCKJAK3BTKTNK2
SCHEMBL4557625 0.85 LCK (0.66) SRCHCKFGFR1LCKJAK3
SCHEMBL4497470 0.84 LCK (0.76) SRCHCKFGFR1LCKJAK3
SCHEMBL4497834 0.83 LCK (0.58) SRCHCKFGFR1LCKJAK3
SCHEMBL4503492 0.83 LCK (0.61) SRCHCKFGFR1LCKJAK3
SCHEMBL4560190 0.81 LCK (0.65) SRCHCKFGFR1LCKJAK3
SCHEMBL5689021 0.81 TP53 (0.65) SRCJAK3BTK
SCHEMBL31612065 0.81 SRC (0.70) SRCHCKFGFR1LCKTNK2
SCHEMBL4507769 0.80 LCK (0.74) SRCHCKFGFR1LCKJAK3

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 SRC 2472/4885HCK 3562/4885FGFR1 1409/4885

“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.