SCHEMBL15907301

SCHEMBL15907301

CCC1=CC(C(=O)Nc2cccc(C#Cc3nnc4ccc(N)cn34)c2)=CC1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 6/20 0.36
PDGFRB P09619 5/20 0.36
LCK P06239 1/20 0.34
TEK Q02763 1/20 0.34
IKBKB O14920 8/20 0.33
PTPN11 Q06124 1/20 0.33
ABL1 P00519 2/20 0.33
BCR P11274 2/20 0.33
BRAF P15056 1/20 0.33
GRM5 P41594 1/20 0.32
CSF1R P07333 1/20 0.32

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
SCHEMBL15907246 0.87 GAA (0.37) KDRPDGFRBPTPN11
SCHEMBL15907316 0.85 CSF1R (0.35) KDRPDGFRBLCKTEKPTPN11
SCHEMBL15907286 0.79 HTT (0.36) KDRPDGFRBIKBKBPTPN11
SCHEMBL15907302 0.77 IKBKB (0.46) KDRPDGFRBLCKTEKIKBKB
SCHEMBL18323164 0.74 IKBKB (0.41) KDRPDGFRBLCKTEKIKBKB
SCHEMBL15907309 0.72 CSF1R (0.37) ABL1CSF1R
SCHEMBL15907278 0.72 PDE4B (0.33) ABL1CSF1R
SCHEMBL15907264 0.69 ABL1 (0.36) KDRLCKTEKABL1CSF1R
SCHEMBL15907307 0.68 CSF1R (0.40) KDRPDGFRBLCKTEKABL1
SCHEMBL18323145 0.68 ALDH1A1 (0.47) KDRPDGFRBLCKTEKIKBKB

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-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 KDR 676/4885PDGFRB 831/4885LCK 13/4885

“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.