SCHEMBL4391307

SCHEMBL4391307

Cc1[nH]c(=O)c(Nc2ccc(C(=O)N3CCOCC3)cn2)cc1-c1cccc(-c2c[nH]c3cc(C(C)(C)C)ccc3c2=O)c1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BTK Q06187 17/20 0.50
CLK2 P49760 1/20 0.47
KDM4E B2RXH2 1/20 0.45
RAB9A P51151 1/20 0.45
TYK2 P29597 1/20 0.42
SRC P12931 1/20 0.41

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
SCHEMBL1725708 0.86 BTK (0.63) BTKCLK2
SCHEMBL3961624 0.80 BTK (0.61) BTKCLK2KDM4ERAB9A
SCHEMBL12850144 0.76 BTK (0.53) BTKCLK2KDM4ERAB9ATYK2
SCHEMBL3963446 0.74 BTK (0.60) BTKCLK2TYK2SRC
SCHEMBL1322606 0.74 BTK (0.77) BTKCLK2SRC
SCHEMBL3965301 0.73 BTK (0.55) BTKCLK2KDM4ERAB9ATYK2
SCHEMBL3668669 0.73 BTK (0.61) BTKCLK2KDM4ERAB9ATYK2
SCHEMBL3654050 0.71 BTK (0.50) BTKCLK2KDM4ERAB9ATYK2
SCHEMBL3668896 0.71 BTK (0.52) BTKCLK2KDM4ERAB9ATYK2
SCHEMBL13894012 0.71 BTK (0.78) BTKCLK2SRC

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-20090306041-A1 Inhibitors of Bruton's tyrosine kinase ROCHE PALO ALTO LLC 2009-12-10 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-20090306041-A1 Inhibitors of Bruton's tyrosine kinase BTK, SYK, LYN BTK 1/4885CLK2 575/4885KDM4E 775/4885

“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.