SCHEMBL9985367

SCHEMBL9985367

Cc1c(NC(=O)c2cc3cccc(F)c3s2)ccc(F)c1-c1cc(Nc2cc(C)n(C)n2)c(=O)[nH]n1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BTK Q06187 14/20 0.50
FGR P09769 1/20 0.50
SRC P12931 1/20 0.50
TEC P42680 1/20 0.50
BMX P51813 1/20 0.50
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
CHRNA7 P36544 4/20 0.34
HTR3A P46098 1/20 0.34
KDM4E B2RXH2 1/20 0.33
GAA P10253 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
SCHEMBL2487499 0.89 BTK (0.63) BTKFGRSRCTECBMX
SCHEMBL2488092 0.84 BTK (0.62) BTKFGRSRCTECBMX
SCHEMBL2489542 0.79 BTK (0.73) BTKFGRSRCTECBMX
SCHEMBL2495112 0.78 BTK (0.64) BTKFGRSRCTECBMX
SCHEMBL2490453 0.77 BTK (0.74) BTKFGRSRCTECBMX
SCHEMBL2492653 0.76 BTK (0.64) BTKFGRSRCTECBMX
SCHEMBL2493558 0.76 BTK (0.64) BTKFGRSRCTECBMX
SCHEMBL2488898 0.76 BTK (0.64) BTKFGRSRCTECBMX
SCHEMBL2492458 0.76 BTK (0.65) BTKFGRSRCTECBMX
SCHEMBL2494014 0.76 BTK (0.65) BTKFGRSRCTECBMX

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110301145-A1 PYRIDAZINONES, METHOD OF MAKING, AND METHOD OF USE THEREOF Gilead Connecticut INc. (US) 2011-12-08 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-20110301145-A1 PYRIDAZINONES, METHOD OF MAKING, AND METHOD OF USE THEREOF BTK, SYK, LCK BTK 1/4885FGR 1105/4885SRC 139/4885

“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.