SCHEMBL12956162

SCHEMBL12956162

Cc1c(NC(=O)c2cc3c(s2)CCCCC3)cccc1-c1cc(Nc2ccc(CN3CCN(C)CC3)nn2)c(=O)n(C)c1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BTK Q06187 20/20 0.67
EGFR P00533 1/20 0.55
BMX P51813 1/20 0.55
JAK3 P52333 1/20 0.55
CD69 Q07108 1/20 0.48

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
SCHEMBL12956031 0.99 BTK (0.68) BTKEGFRBMXJAK3CD69
SCHEMBL13044170 0.94 BTK (0.65) BTKEGFRBMXJAK3
SCHEMBL1039125 0.93 BTK (0.66) BTKEGFRBMXJAK3
SCHEMBL1040891 0.88 BTK (0.70) BTKEGFRBMXJAK3CD69
SCHEMBL12956349 0.87 BTK (0.66) BTKEGFRBMXJAK3CD69
SCHEMBL12955977 0.87 BTK (0.66) BTKEGFRBMXJAK3CD69
SCHEMBL13044107 0.87 BTK (0.67) BTKEGFRBMXJAK3CD69
SCHEMBL12956387 0.86 BTK (0.65) BTKEGFRBMXJAK3CD69
SCHEMBL1038574 0.86 BTK (0.65) BTKEGFRBMXJAK3CD69
SCHEMBL12956103 0.86 BTK (0.66) BTKEGFRBMXJAK3CD69

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
EP-2079726-B1 SUBSTITUTED AMIDES, METHOD OF MAKING, AND METHOD OF USE THEREOF CGI PHARMACEUTICALS INC (US) 2011-01-26 EP disclosed
US-7838523-B2 Certain substituted amides, method of making, and method of use thereof CGI PHARMACEUTICALS, INC. (US) 2010-11-23 US disclosed
US-7838523-B2 Certain substituted amides, method of making, and method of use thereof CGI PHARMACEUTICALS, INC. (US) 2010-11-23 US disclosed
US-20080153834-A1 Certain Substituted Amides, Method of Making, and Method of Use Thereof GILEAD CONNECTICUT, INC. 2008-06-26 US disclosed
US-20080153834-A1 Certain Substituted Amides, Method of Making, and Method of Use Thereof GILEAD CONNECTICUT, INC. 2008-06-26 US disclosed
WO-2008033857-A2 SUBSTITUTED AMIDES, METHOD OF MAKING, AND METHOD OF USE THEREOF CGI PHARMACEUTICALS, INC. (US) 2008-03-20 WO 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-20080153834-A1 Certain Substituted Amides, Method of Making, and Method of Use Thereof BTK, SYK, MYD88 BTK 1/4885EGFR 486/4885BMX 44/4885

“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.