SCHEMBL6525604

SCHEMBL6525604

CCN1CCNC(=O)C1c1ccc(Nc2nc(Br)cn(CC)c2=O)cc1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BTK Q06187 2/20 0.35
TYK2 P29597 3/20 0.34
CALCRL Q16602 1/20 0.30

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
SCHEMBL1204895 0.91 BTK (0.40) BTKTYK2
SCHEMBL19545087 0.79 BTK (0.49) BTK
SCHEMBL161076 0.79 BTK (0.49) BTK
SCHEMBL3698523 0.74 ALDH1A1 (0.30)
SCHEMBL1204289 0.72 CYP19A1 (0.37) CALCRL
SCHEMBL1204826 0.71 BTK (0.42) BTK
SCHEMBL6525601 0.70 POLB (0.31) CALCRL
SCHEMBL1204149 0.68 BTK (0.51) BTK
SCHEMBL1205490 0.68 BTK (0.51) BTK
SCHEMBL1203837 0.68 BTK (0.51) BTK

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-8247550-B2 Certain substituted amides, method of making, and method of use thereof GILEAD CONNECTICUT, INC. (US) 2012-08-21 US disclosed
US-20110059944-A1 Certain Substituted Amides, Method of Making, and Method of Use Thereof GILEAD CONNECTICUT, INC. 2011-03-10 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-20110059944-A1 Certain Substituted Amides, Method of Making, and Method of Use Thereof BTK, SYK, MYD88 BTK 1/4885TYK2 28/4885CALCRL 2538/4885

“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.