SCHEMBL17545936

SCHEMBL17545936

C[Si](C)(C)CCOCn1ccc2c(O[C@@H]3CCCN(C(=O)CNc4cc(Cl)cc(Cl)c4)C3)ncnc21

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BTK Q06187 19/20 0.45
CYP3A4 P08684 1/20 0.39
PIK3CD O00329 1/20 0.38

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
SCHEMBL17527355 0.83 BTK (0.46) BTKPIK3CD
SCHEMBL17527353 0.83 BTK (0.46) BTKPIK3CD
SCHEMBL18419032 0.81 PIK3CD (0.49) PIK3CD
SCHEMBL17527387 0.81 PIK3CD (0.49) PIK3CD
SCHEMBL17545942 0.78 PIK3CD (0.46) PIK3CD
SCHEMBL31124313 0.77 PIK3CD (0.54) PIK3CD
SCHEMBL18419031 0.77 BTK (0.69) BTKCYP3A4
SCHEMBL20183873 0.74 GPR119 (0.51) PIK3CD
SCHEMBL17545928 0.72 BTK (0.71) BTKCYP3A4
SCHEMBL17545929 0.72 BTK (0.71) BTKCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170027956-A1 HETEROCYCLIC TYROSINE KINASE INHIBITORS BIOGEN IDEC MA INC. 2017-02-02 US disclosed
US-20170027956-A1 HETEROCYCLIC TYROSINE KINASE INHIBITORS BIOGEN IDEC MA INC. 2017-02-02 US disclosed
US-9273028-B2 Heterocyclic tyrosine kinase inhibitors BIOGEN MA INC. (US) 2016-03-01 US disclosed
US-9273028-B2 Heterocyclic tyrosine kinase inhibitors BIOGEN MA INC. (US) 2016-03-01 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-20170027956-A1 HETEROCYCLIC TYROSINE KINASE INHIBITORS TEC, ABL1, LCK BTK 4/4885CYP3A4 4034/4885PIK3CD 108/4885

“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.