SCHEMBL4078372

SCHEMBL4078372

Cc1c(N)cccc1-c1cc(Nc2ccc(C(=O)N3CCOCC3)cn2)c(=O)n(C)c1

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BTK Q06187 18/20 0.73
CLK2 P49760 1/20 0.64
KDM4E B2RXH2 1/20 0.54
RAB9A P51151 1/20 0.54
SRC P12931 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
SCHEMBL5127683 0.92 BTK (0.62) BTKCLK2
SCHEMBL12602983 0.92 BTK (0.75) BTKCLK2KDM4ERAB9ASRC
SCHEMBL3963393 0.90 BTK (0.71) BTKCLK2KDM4ERAB9A
SCHEMBL3867754 0.90 BTK (0.74) BTKCLK2KDM4ERAB9ASRC
SCHEMBL171985 0.88 BTK (0.70) BTKCLK2KDM4ERAB9A
SCHEMBL12650372 0.87 BTK (0.70) BTKCLK2KDM4ERAB9ASRC
SCHEMBL13894070 0.87 BTK (0.88) BTKCLK2
SCHEMBL708176 0.86 BTK (0.64) BTKCLK2KDM4ERAB9A
SCHEMBL5124318 0.85 BTK (0.55) BTKCLK2KDM4ERAB9ASRC
SCHEMBL3804473 0.85 BTK (0.63) BTKCLK2KDM4ERAB9ASRC

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 1/4885CLK2 2498/4885KDM4E 845/4885

“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.