SCHEMBL17545848

SCHEMBL17545848

Cc1ccc(S(=O)(=O)n2ccc3c(N[C@H]4CCCN(C(=O)CNc5cccc(Cl)c5)C4)ncnc32)cc1

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BTK Q06187 17/20 0.63
PIK3CD O00329 2/20 0.41
PAK1 Q13153 1/20 0.40
PIK3CA P42336 1/20 0.40

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
SCHEMBL17545834 0.94 BTK (0.61) BTK
SCHEMBL17527474 0.92 BTK (0.52) BTKPIK3CDPIK3CA
SCHEMBL17527472 0.92 BTK (0.52) BTKPIK3CDPIK3CA
SCHEMBL17545957 0.92 BTK (0.62) BTK
SCHEMBL17527406 0.92 BTK (0.52) BTKPIK3CDPIK3CA
SCHEMBL17527408 0.92 BTK (0.52) BTKPIK3CDPIK3CA
SCHEMBL17545831 0.90 BTK (0.64) BTK
SCHEMBL18421256 0.90 BTK (0.64) BTK
SCHEMBL6128791 0.90 BTK (0.56) BTKPIK3CD
SCHEMBL10228638 0.90 BTK (0.56) BTKPIK3CD

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 4/4885PIK3CD 108/4885PAK1 133/4885

“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.