SCHEMBL15907243

SCHEMBL15907243

NC(=O)c1ccc(C(=O)Nc2cccc(C#Cc3nnc4ccccn34)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 6/20 0.49
KDR P35968 6/20 0.49
IKBKB O14920 6/20 0.46
PTPN11 Q06124 1/20 0.42
RAB9A P51151 3/20 0.40
LMNA P02545 2/20 0.40
POLB P06746 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GFER P55789 1/20 0.40
SIRT2 Q8IXJ6 1/20 0.39
GAA P10253 1/20 0.39
NAMPT P43490 1/20 0.39
PLAU P00749 1/20 0.39

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
SCHEMBL15907244 0.83 NPC1 (0.40) KDRRAB9APOLBSMN1; SMN2KDM4E
SCHEMBL18323148 0.80 GRM5 (0.41) PDGFRBKDRIKBKBPTPN11RAB9A
SCHEMBL15907241 0.79 PLAU (0.39) KDRRAB9APOLBSMN1; SMN2KDM4E
SCHEMBL15907238 0.76 KMT2A (0.45) RAB9APOLBKDM4E
SCHEMBL15907246 0.76 GAA (0.37) PDGFRBKDRPTPN11RAB9ALMNA
SCHEMBL15907158 0.74 KIT (0.55)
SCHEMBL15907253 0.74 BCAT2 (0.45) PDGFRBKDRIKBKBRAB9ASMN1; SMN2
SCHEMBL15907242 0.74 RAB9A (0.39) RAB9APOLBSMN1; SMN2KDM4EGAA
SCHEMBL18323145 0.73 ALDH1A1 (0.47) PDGFRBKDRIKBKBRAB9APOLB
SCHEMBL15907302 0.71 IKBKB (0.46) PDGFRBKDRIKBKBRAB9APOLB

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 PDGFRB 831/4885KDR 676/4885IKBKB 158/4885

“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.