SCHEMBL13527005

SCHEMBL13527005

CC(C)(C)Nc1cc(-c2cccc(-c3c[nH]c4cc(C(C)(C)C)ccc4c3=O)c2CO)cn2ccnc12

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BTK Q06187 9/20 0.37
SYK P43405 9/20 0.35
TNKS O95271 1/20 0.34
CLK2 P49760 1/20 0.33

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
SCHEMBL13527004 0.90 BTK (0.36) BTKSYKTNKS
SCHEMBL13531801 0.85 BTK (0.40) BTKSYKTNKS
SCHEMBL13526978 0.79 BTK (0.45) BTK
SCHEMBL13527017 0.77 BTK (0.61) BTK
SCHEMBL13531799 0.76 BTK (0.39) BTKSYKTNKS
SCHEMBL13526956 0.74 BTK (0.53) BTK
SCHEMBL13526979 0.71 BTK (0.38) BTKTNKS
SCHEMBL13547730 0.70 MEN1 (0.36) TNKS
SCHEMBL13527018 0.70 BTK (0.52) BTK
SCHEMBL13526953 0.67 BTK (0.44) BTKTNKS

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-8324211-B2 6-Dimethylamino-2-(2-hydroxymethyl-3-{8-[5-(morpholine-4-carbonyl)-pyridin-2-ylamino]-imidazo[1,2-b]pyridazin-6-yl }-phenyl)-3,4-dihydro-2H-isoquinolin-1-one; asthma, lupus ; inhibit Btk ROCHE PALO ALTO LLC (US) 2012-12-04 US disclosed
US-20100016301-A1 Inhibitors of bruton's tyrosine kinase ROCHE PALO ALTO LLC 2010-01-21 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-20100016301-A1 Inhibitors of bruton's tyrosine kinase BTK, SYK, LYN BTK 1/4885SYK 2/4885TNKS 354/4885

“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.