SCHEMBL6420903

SCHEMBL6420903

CN(C)CCOc1ccc2c(c1)nc(C(N)=O)n2CC(C)(C)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 3/20 0.43
SRC P12931 3/20 0.43
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 2/20 0.42
RPS6KB1 P23443 2/20 0.41
DYRK3 O43781 1/20 0.41
MAP4K4 O95819 1/20 0.41
PIM1 P11309 1/20 0.41
CSNK2A1 P68400 1/20 0.41
PKN2 Q16513 1/20 0.41
PIM3 Q86V86 1/20 0.41
BRSK1 Q8TDC3 1/20 0.41
AURKB Q96GD4 1/20 0.41
HIPK2 Q9H2X6 1/20 0.41
CLK4 Q9HAZ1 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
STK17A Q9UEE5 1/20 0.41
MAP4K5 Q9Y4K4 1/20 0.41
HPGD P15428 1/20 0.39
CHEK1 O14757 1/20 0.39

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
SCHEMBL6420907 0.85 FGFR1 (0.46) FGFR1SRCKDM4EALDH1A1HPGD
SCHEMBL6270713 0.83 TDP1 (0.47) KDM4EALDH1A1CNR2POLB
SCHEMBL6271293 0.77 JAK2 (0.45) CNR2INSRITK
SCHEMBL6420483 0.77 KDM4E (0.45) KDM4ECLK4CHEK1CNR2AURKA
SCHEMBL6270096 0.77 GRM2 (0.49) INSRITK
SCHEMBL6270636 0.74 CNR2 (0.40) CNR2INSRITK
SCHEMBL6277067 0.74 ITK (0.39) CNR2INSRITK
SCHEMBL6274410 0.74 ITK (0.39) CNR2INSRITK
SCHEMBL6415122 0.72 ITK (0.39) CNR2INSRITK
SCHEMBL6420350 0.71 ITK (0.50) CHEK1INSRITK

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-20050209284-A1 Tec kinase inhibitors BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 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-20050209284-A1 Tec kinase inhibitors TEC, ITK, TXK FGFR1 851/4885SRC 313/4885KDM4E 2880/4885

“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.