SCHEMBL18268652

SCHEMBL18268652

Cc1ncc(COc2cc(F)cc(Oc3ccc(-c4nn(C[C@H]5CCCN5C#N)c5ncnc(N)c45)cc3)c2)cn1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.55
▸ EGFR P00533 3/20 0.51
▸ LCK P06239 3/20 0.51
▸ ITK Q08881 2/20 0.51
▸ JAK3 P52333 1/20 0.48

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
SCHEMBL18268845 0.87 BTK (0.60) BTKEGFRLCKITKJAK3
SCHEMBL18268993 0.86 BTK (0.71) BTKEGFRLCKITKJAK3
SCHEMBL18268994 0.86 BTK (0.62) BTKEGFRLCKITKJAK3
SCHEMBL18268846 0.86 BTK (0.69) BTKEGFRLCKITKJAK3
SCHEMBL18268995 0.86 BTK (0.62) BTKEGFRLCKITKJAK3
SCHEMBL18269031 0.85 BTK (0.62) BTKEGFRLCKITKJAK3
SCHEMBL18268989 0.85 BTK (0.58) BTKEGFRLCKITKJAK3
SCHEMBL18268975 0.84 BTK (0.58) BTKEGFRLCKITKJAK3
SCHEMBL18268690 0.84 BTK (0.56) BTKEGFRLCKITKJAK3
SCHEMBL18269032 0.83 BTK (0.57) BTKEGFRLCKITKJAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180179210-A1 Inhibitors of the TEC Kinase Enzyme Family PHARMASCIENCE INC. (CA) 2018-06-28 — — US disclosed
WO-2016187723-A1 INHIBITORS OF THE TEC KINASE ENZYME FAMILY PHARMASCIENCE INC. (CA) 2016-12-01 — — WO 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-20180179210-A1 Inhibitors of the TEC Kinase Enzyme Family TEC, BTK, LCK BTK 2/4885EGFR 671/4885LCK 3/4885

“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.

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