SCHEMBL4496883

SCHEMBL4496883

Cc1cccc(C)c1NC(=O)c1cnc(Nc2ccc(N3CCN(C(C)C)CC3)cc2)nc1Oc1ccc(Cl)cc1Cl

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LCK P06239 2/20 0.59
JAK3 P52333 2/20 0.59
BTK Q06187 1/20 0.59
TNK2 Q07912 1/20 0.59
SRC P12931 9/20 0.51
HCK P08631 1/20 0.49
FGFR1 P11362 1/20 0.49
MT-CO2 P00403 1/20 0.47
WEE1 P30291 2/20 0.46
KCNH2 Q12809 1/20 0.45
MAP3K7 O43318 3/20 0.45
MAP2K1 Q02750 3/20 0.45
EGFR P00533 2/20 0.44
JAK2 O60674 1/20 0.44
BLK P51451 1/20 0.44
BMX P51813 1/20 0.44
MAPK1 P28482 1/20 0.44
FLT3 P36888 1/20 0.44

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
SCHEMBL4508406 0.94 LCK (0.59) LCKJAK3BTKTNK2SRC
SCHEMBL4487951 0.93 LCK (0.58) LCKJAK3BTKTNK2SRC
SCHEMBL4496676 0.93 LCK (0.59) LCKJAK3BTKTNK2SRC
SCHEMBL4481579 0.93 LCK (0.59) LCKJAK3BTKTNK2SRC
SCHEMBL4497239 0.92 LCK (0.61) LCKJAK3BTKTNK2SRC
SCHEMBL4484606 0.92 LCK (0.65) LCKJAK3BTKTNK2SRC
SCHEMBL4497798 0.91 LCK (0.56) LCKJAK3BTKTNK2SRC
SCHEMBL4500413 0.90 JAK3 (0.58) LCKJAK3BTKTNK2SRC
SCHEMBL4496653 0.90 JAK3 (0.59) LCKJAK3BTKTNK2SRC
SCHEMBL4498259 0.90 LCK (0.62) LCKJAK3BTKTNK2SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050209221-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2005-09-22 US 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 LCK 33/4885JAK3 900/4885BTK 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.