SCHEMBL6306385

SCHEMBL6306385

CCN(CC)C(=O)c1ccc(Oc2nc(Nc3ccc(N4CCN(CN(C)C)CC4)cc3)ncc2C(=O)Nc2c(C)cccc2C)c(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 3/20 0.56
JAK3 P52333 3/20 0.56
TNK2 Q07912 2/20 0.56
BTK Q06187 1/20 0.56
SRC P12931 10/20 0.47
FGFR1 P11362 2/20 0.44
HCK P08631 1/20 0.44
KDR P35968 1/20 0.42
TEK Q02763 1/20 0.42
MAPK14 Q16539 1/20 0.42
MAP3K7 O43318 2/20 0.42
MAP2K1 Q02750 2/20 0.42
CCNK O75909 1/20 0.41
CCNA2 P20248 1/20 0.41
CDK2 P24941 1/20 0.41
CCND3 P30281 1/20 0.41
CDK9 P50750 1/20 0.41
CDK6 Q00534 1/20 0.41
BRD4 O60885 1/20 0.40
JAK2 O60674 1/20 0.40

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
SCHEMBL4490885 0.94 LCK (0.55) LCKJAK3TNK2BTKSRC
SCHEMBL4490532 0.93 JAK3 (0.54) LCKJAK3TNK2BTKSRC
SCHEMBL4507650 0.92 JAK3 (0.59) LCKJAK3TNK2BTKSRC
SCHEMBL4509205 0.90 LCK (0.57) LCKJAK3TNK2BTKSRC
SCHEMBL5686240 0.86 JAK3 (0.48) LCKJAK3TNK2BTKSRC
SCHEMBL4505399 0.85 LCK (0.55) LCKJAK3TNK2BTKSRC
SCHEMBL4490903 0.84 LCK (0.60) LCKJAK3TNK2BTKSRC
SCHEMBL4496045 0.83 LCK (0.48) LCKJAK3TNK2BTKSRC
SCHEMBL4507505 0.83 SIK1 (0.56) LCKJAK3TNK2BTKSRC
SCHEMBL5689097 0.83 LCK (0.57) LCKJAK3TNK2BTKSRC

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 1 patent. 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

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 900/4885TNK2 1854/4885

“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.