SCHEMBL4498499

SCHEMBL4498499

Cc1cccc(C)c1NC(=O)c1cnc(Nc2ccc(N3CCN(C)CC3)cc2)nc1Oc1ccccc1C(N)=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 4/20 0.67
JAK3 P52333 2/20 0.67
BTK Q06187 1/20 0.67
TNK2 Q07912 1/20 0.67
CDK4 P11802 2/20 0.58
CCND1 P24385 2/20 0.58
KDR P35968 3/20 0.57
MAPK14 Q16539 3/20 0.57
MAP3K7 O43318 4/20 0.56
MAP2K1 Q02750 4/20 0.56
MAPK1 P28482 3/20 0.56
SRC P12931 6/20 0.56
CDK1 P06493 1/20 0.56
CDK2 P24941 1/20 0.56
HCK P08631 1/20 0.55
FGFR1 P11362 1/20 0.55
STAT6 P42226 1/20 0.54
SLC2A1 P11166 1/20 0.53
SYK P43405 2/20 0.53
FLT3 P36888 1/20 0.52

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
SCHEMBL4486334 0.92 LCK (0.71) LCKJAK3BTKTNK2CDK4
SCHEMBL4488733 0.91 LCK (0.65) LCKJAK3BTKTNK2CDK4
SCHEMBL4500662 0.90 LCK (0.68) LCKJAK3BTKTNK2CDK4
SCHEMBL4496078 0.90 LCK (0.68) LCKJAK3BTKTNK2CDK4
SCHEMBL4499622 0.90 LCK (0.68) LCKJAK3BTKTNK2CDK4
SCHEMBL4481001 0.89 LCK (0.74) LCKJAK3BTKTNK2CDK4
SCHEMBL4493578 0.89 LCK (0.72) LCKJAK3BTKTNK2CDK4
SCHEMBL4504109 0.89 LCK (0.84) LCKJAK3BTKTNK2CDK4
SCHEMBL4487350 0.89 LCK (0.66) LCKJAK3BTKTNK2CDK4
SCHEMBL4492920 0.88 LCK (0.68) LCKJAK3BTKTNK2CDK4

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.