SCHEMBL4095557

SCHEMBL4095557

CNC(=O)Nc1cc(-c2cccc(NC(=O)c3ccc(C(C)(C)C#N)cc3)c2C)nn2ccnc12

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BTK Q06187 10/20 0.55
RAF1 P04049 8/20 0.48
BRAF P15056 6/20 0.48
SYK P43405 2/20 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
SCHEMBL13821203 0.92 BTK (0.55) BTKRAF1BRAFSYK
SCHEMBL4086761 0.91 BTK (0.54) BTKRAF1BRAFSYK
SCHEMBL4090528 0.91 BTK (0.65) BTKSYK
SCHEMBL4091766 0.90 BTK (0.58) BTKRAF1BRAFSYK
SCHEMBL4081255 0.87 BTK (0.55) BTKRAF1BRAFSYK
SCHEMBL4090445 0.85 BTK (0.54) BTKRAF1BRAFSYK
SCHEMBL4086089 0.84 BTK (0.52) BTKSYK
SCHEMBL4087271 0.84 BTK (0.55) BTKRAF1BRAFSYK
SCHEMBL4095483 0.83 BTK (0.65) BTK
SCHEMBL4095844 0.83 BTK (0.51) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-8426441-B2 Inhibitors of bruton's tyrosine kinase ROCHE PALO ALTO LLC (US) 2013-04-23 US disclosed
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
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 1/4885RAF1 99/4885BRAF 106/4885

“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.