SCHEMBL4070000

SCHEMBL4070000

CN1CCN(c2ccc(Nc3cc(-c4cc(F)cc(N)c4F)cn(C)c3=O)nc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BTK Q06187 20/20 0.58
YES1 P07947 1/20 0.49
FGR P09769 1/20 0.49
TEC P42680 1/20 0.49
BMX P51813 1/20 0.49
KCNH2 Q12809 1/20 0.49
SLK Q9H2G2 1/20 0.49

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
SCHEMBL4069996 0.88 BTK (0.57) BTKYES1FGRTECBMX
SCHEMBL1322776 0.79 BTK (0.81) BTK
SCHEMBL3970043 0.79 BTK (0.56) BTKYES1FGRTECBMX
SCHEMBL1322892 0.78 BTK (0.59) BTK
SCHEMBL12118073 0.78 BTK (0.59) BTK
SCHEMBL708026 0.77 BTK (0.52) BTKKCNH2
SCHEMBL2594784 0.76 BTK (0.84) BTK
SCHEMBL5127571 0.76 BTK (0.57) BTK
SCHEMBL10255445 0.75 BTK (0.80) BTK
SCHEMBL10255856 0.75 BTK (0.89) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2081923-B1 CERTAIN SUBSTITUTED AMIDES, METHOD OF MAKING, AND METHOD OF USE THEREOF GILEAD CONNECTICUT INC (US) 2016-03-16 EP disclosed
EP-2081923-A1 CERTAIN SUBSTITUTED AMIDES, METHOD OF MAKING, AND METHOD OF USE THEREOF CGI Pharmaceuticals, Inc. (US) 2009-07-29 EP disclosed
US-20080139557-A1 CERTAIN SUBSTITUTED AMIDES, METHOD OF MAKING, AND METHOD OF USE THEREOF GILEAD CONNECTICUT, INC. 2008-06-12 US disclosed
WO-2008033854-A1 CERTAIN 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-20080139557-A1 CERTAIN SUBSTITUTED AMIDES, METHOD OF MAKING, AND METHOD OF USE THEREOF BTK, SYK, MYD88 BTK 1/4885YES1 263/4885FGR 1772/4885

“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.