SCHEMBL4942072

SCHEMBL4942072

COc1ccc(NC(=O)Nc2ccc(C(=O)Nc3ccc(C)c(Nc4nc(-c5cccnc5)cs4)c3)cc2)c(OC)c1.Cc1ccc(C(N)=O)cc1Nc1nc(-c2cccnc2)cs1.Cc1ccc(NC(=O)c2ccc(CN3CCCC3)cc2)cc1Nc1nc(-c2cccnc2)cs1.Cc1ccc(NC(=O)c2ccc(NC(=O)Nc3ccc(F)cc3)cc2)cc1Nc1nc(-c2cccnc2)cs1.Cc1ccc(NC(=O)c2ccc(NC(=O)Nc3ccccc3I)cc2)cc1Nc1nc(-c2cccnc2)cs1.Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)cs1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 15/20 0.52
BCR P11274 14/20 0.52
KIT P10721 8/20 0.52
PDGFRB P09619 4/20 0.52
CSF1R P07333 4/20 0.52
ABL2 P42684 4/20 0.52
EGFR P00533 3/20 0.52
LCK P06239 3/20 0.52
FYN P06241 3/20 0.52
LYN P07948 3/20 0.52
SRC P12931 3/20 0.52
BRAF P15056 3/20 0.52
NQO2 P16083 3/20 0.52
EPHA8 P29322 3/20 0.52
FRK P42685 3/20 0.52
DDR1 Q08345 3/20 0.52
DDR2 Q16832 3/20 0.52
MAP3K20 Q9NYL2 3/20 0.52
ERBB2 P04626 2/20 0.52
FGR P09769 2/20 0.52

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
SCHEMBL5524139 0.95 ABL1 (0.57) ABL1BCRKITPDGFRBCSF1R
SCHEMBL4942076 0.88 ABL1 (0.49) ABL1BCRKITPDGFRBCSF1R
SCHEMBL6359358 0.86 ABL1 (0.70) ABL1BCRKITPDGFRBCSF1R
SCHEMBL5201864 0.82 ABL1 (0.64) ABL1BCRKITPDGFRBCSF1R
SCHEMBL717503 0.78 NPC1 (0.64) ABL1BCRKITPDGFRBCSF1R
SCHEMBL717173 0.76 ABL1 (0.88) ABL1BCRKITPDGFRBCSF1R
SCHEMBL717184 0.75 ABL1 (0.87) ABL1BCRKITPDGFRBCSF1R
SCHEMBL716308 0.75 ABL1 (0.67) ABL1BCRKITPDGFRBCSF1R
SCHEMBL6359361 0.75 ABL1 (0.58) ABL1BCRKITPDGFRBCSF1R
SCHEMBL6279931 0.74 LCK (0.69) ABL1BCRKITPDGFRBCSF1R

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
US-20080146585-A1 Use Of C-Kit Inhibitors For Treating Inflammatory Muscle Disorders Including Myositis And Muscular Dystrophy AB SCIENCE 2008-06-19 US disclosed
US-20080004279-A1 Use of C-Kit Inhibitors for Treating Plasmodium Related Diseases AB SCIENCE (FR) 2008-01-03 US disclosed
US-20070249628-A1 Use of Mast Cells Inhibitors for Treating Patients Exposed to Chemical or Biological Weapons MOUSSY ALAIN 2007-10-25 US disclosed
US-20070225293-A1 Use of C-Kit Inhibitors for Treating Fibrosis AB SCIENCE 2007-09-27 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 (4 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-20080146585-A1 Use Of C-Kit Inhibitors For Treating Inflammatory Muscle Disorders Including Myositis And Muscular Dystrophy KIT, CPA3, CMA1 ABL1 1013/4885BCR 3062/4885KIT 1/4885
US-20070225293-A1 Use of C-Kit Inhibitors for Treating Fibrosis KIT, CPA3, CMA1 ABL1 419/4885BCR 2636/4885KIT 1/4885
US-20080004279-A1 Use of C-Kit Inhibitors for Treating Plasmodium Related Diseases KIT, JAK3, MAP3K3 ABL1 5/4885BCR 349/4885KIT 1/4885
US-20070249628-A1 Use of Mast Cells Inhibitors for Treating Patients Exposed to Chemical or Biological Weapons KIT, CPA3, CMA1 ABL1 176/4885BCR 1450/4885KIT 1/4885

“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.