SCHEMBL15907245

SCHEMBL15907245

CCC1=CC(NC(=O)c2ccc(C)c(C#Cc3nnc4ccccn34)c2)=CC1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 18/20 0.43
ABL2 P42684 1/20 0.39
DDR1 Q08345 2/20 0.38
DDR2 Q16832 1/20 0.38
LMNA P02545 1/20 0.38
KIT P10721 1/20 0.38

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
SCHEMBL15907158 0.81 KIT (0.55) ABL1DDR1DDR2KIT
SCHEMBL15907159 0.76 MEN1 (0.40) ABL1DDR1LMNAKIT
SCHEMBL15800809 0.76 ABL1 (0.42) ABL1DDR1LMNAKIT
SCHEMBL15907246 0.72 GAA (0.37) DDR1DDR2LMNAKIT
SCHEMBL18323648 0.72 ABL1 (0.64) ABL1ABL2KIT
SCHEMBL15907307 0.70 CSF1R (0.40) ABL1DDR1DDR2LMNAKIT
Vamotinib SCHEMBL15789568 0.70 ABL1 (0.80) ABL1ABL2DDR1DDR2KIT
Vamotinib SCHEMBL29441255 0.70 ABL1 (0.80) ABL1ABL2DDR1DDR2KIT
Vamotinib SCHEMBL19475244 0.69 ABL1 (0.76) ABL1ABL2DDR1DDR2KIT
SCHEMBL15907264 0.68 ABL1 (0.36) ABL1DDR1KIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9522910-B2 Protein kinase inhibitors (variants), use thereof in treating oncological diseases and a pharmaceutical composition based thereon Obshchestvo s ogranichennoy otvetstvennostyou “Fusion Pharma” (RU) 2016-12-20 US disclosed
US-9522910-B2 Protein kinase inhibitors (variants), use thereof in treating oncological diseases and a pharmaceutical composition based thereon Obshchestvo s ogranichennoy otvetstvennostyou “Fusion Pharma” (RU) 2016-12-20 US disclosed
US-20140213592-A1 Protein Kinase Inhibitors (Variants), Use Thereof in Treating Oncological Diseases and a Pharmaceutical Composition Based Thereon OBSHCHESTVO S OGRANICHENNOY OTVETSTVENNOSTYOU "FUSION PHARMA" (RU) 2014-07-31 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-20140213592-A1 Protein Kinase Inhibitors (Variants), Use Thereof in Treating Oncological Diseases and a Pharmaceutical Composition Based Thereon ABL1, ABL2, MAP3K6 ABL1 1/4885ABL2 2/4885DDR1 2472/4885

“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.