SCHEMBL4090547

SCHEMBL4090547

Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cc(Nc2ccnc(N3CCC(O)C3)n2)c2nccn2c1

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BTK Q06187 14/20 0.60
CCNE1 P24864 5/20 0.43
CDK2 P24941 5/20 0.43
SYK P43405 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
SCHEMBL4080598 1.00 BTK (0.60) BTKCCNE1CDK2SYK
SCHEMBL4091543 0.93 BTK (0.59) BTKCCNE1CDK2SYK
SCHEMBL4080354 0.93 BTK (0.59) BTKCCNE1CDK2SYK
SCHEMBL4086707 0.91 BTK (0.60) BTKSYK
SCHEMBL13771593 0.85 BTK (0.49) BTKCCNE1CDK2
SCHEMBL4090391 0.83 BTK (0.56) BTKSYK
SCHEMBL4090396 0.83 BTK (0.56) BTKSYK
SCHEMBL13821550 0.82 BTK (0.56) BTKSYK
SCHEMBL103720 0.82 BTK (0.47) BTKCCNE1CDK2
SCHEMBL4091142 0.81 BTK (0.65) BTKSYK

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-8426441-B2 Inhibitors of bruton's tyrosine kinase ROCHE PALO ALTO LLC (US) 2013-04-23 US claimed
US-20090186898-A1 Inhibitors of bruton's tyrosine kinase ROCHE PALO ALTO LLC 2009-07-23 US claimed
US-8426441-B2 Inhibitors of bruton's tyrosine kinase ROCHE PALO ALTO LLC (US) 2013-04-23 US disclosed
US-20090186898-A1 Inhibitors of bruton's tyrosine kinase ROCHE PALO ALTO LLC 2009-07-23 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-20090186898-A1 Inhibitors of bruton's tyrosine kinase BTK, SYK, LYN BTK 1/4885CCNE1 612/4885CDK2 153/4885

“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.