SCHEMBL5489182

SCHEMBL5489182

Cc1ccc(C(N)=O)cc1Cc1nc(-c2cccnc2)cs1.Cc1ccc(NC(=O)c2ccc(-c3ccncc3)cc2)cc1Cc1nc(-c2cccnc2)cs1.Cc1ccc(NC(=O)c2cccc(C#N)c2)cc1Nc1nc(-c2cccnc2)cs1.Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2F)cc1Nc1nc(-c2cccnc2)cs1.Cc1ccc(NC(=O)c2cccc(OCCN3CCOCC3)c2)cc1Nc1nc(-c2cccnc2)cs1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 13/20 0.44
BCR P11274 10/20 0.44
CSF1R P07333 4/20 0.44
KIT P10721 4/20 0.44
LYN P07948 2/20 0.44
PDGFRB P09619 2/20 0.44
EGFR P00533 1/20 0.44
ERBB2 P04626 1/20 0.44
LCK P06239 1/20 0.44
FYN P06241 1/20 0.44
YES1 P07947 1/20 0.44
HCK P08631 1/20 0.44
FGR P09769 1/20 0.44
PIM1 P11309 1/20 0.44
SLC25A6 P12236 1/20 0.44
SRC P12931 1/20 0.44
BRAF P15056 1/20 0.44
NQO2 P16083 1/20 0.44
PDGFRA P16234 1/20 0.44
EPHA3 P29320 1/20 0.44

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
SCHEMBL5091638 0.98 ABL1 (0.44) ABL1BCRCSF1RKITLYN
SCHEMBL5489183 0.91 ABL1 (0.42) ABL1BCRCSF1RKITLYN
SCHEMBL5091643 0.90 ABL1 (0.42) ABL1BCRCSF1RKITLYN
SCHEMBL1377908 0.87 ABL1 (0.55) ABL1BCRCSF1RKITLYN
SCHEMBL1377630 0.83 ABL1 (0.46) ABL1BCRCSF1RKITLYN
SCHEMBL1377910 0.82 ABL1 (0.54) ABL1BCRCSF1RKITLYN
SCHEMBL716373 0.79 ABL1 (0.63) ABL1BCRCSF1RKITLYN
SCHEMBL714884 0.72 TEK (0.61) ABL1BCRCSF1RKITLYN
SCHEMBL717070 0.71 ABL1 (0.65) ABL1BCRCSF1RKITLYN
SCHEMBL5176339 0.71 ABL1 (0.63) ABL1BCRCSF1RKITLYN

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-20070249628-A1 Use of Mast Cells Inhibitors for Treating Patients Exposed to Chemical or Biological Weapons MOUSSY ALAIN 2007-10-25 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-20070249628-A1 Use of Mast Cells Inhibitors for Treating Patients Exposed to Chemical or Biological Weapons KIT, CPA3, CMA1 ABL1 176/4885BCR 1450/4885CSF1R 277/4885

“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.