SCHEMBL1203378

SCHEMBL1203378

NS(=O)(=O)c1ccc(CNc2ccc3ncc(C(=O)O)n3n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 5/20 0.56
NTRK3 Q16288 3/20 0.56
NTRK2 Q16620 3/20 0.56
FYN P06241 4/20 0.47
MKNK1 Q9BUB5 1/20 0.47
PIM1 P11309 2/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
JAK2 O60674 1/20 0.43
ABL1 P00519 1/20 0.43
INSR P06213 1/20 0.43
LCK P06239 1/20 0.43
CSF1R P07333 1/20 0.43
LYN P07948 1/20 0.43
RET P07949 1/20 0.43
IGF1R P08069 1/20 0.43
MET P08581 1/20 0.43
ROS1 P08922 1/20 0.43
PDGFRB P09619 1/20 0.43
FGR P09769 1/20 0.43

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
SCHEMBL1202556 0.86 NTRK1 (0.52) NTRK1NTRK3NTRK2FYNPIM1
SCHEMBL2902453 0.85 PIM1 (0.61) NTRK1NTRK3NTRK2FYNMKNK1
SCHEMBL1202088 0.84 FYN (0.63) NTRK1NTRK3NTRK2FYNMKNK1
SCHEMBL1203600 0.81 FYN (0.59) NTRK1FYNMKNK1PIM1NPC1
SCHEMBL102639 0.81 NTRK1 (0.65) NTRK1NTRK3NTRK2FYNMKNK1
SCHEMBL1054219 0.81 PIM1 (0.71) NTRK1NTRK3NTRK2FYNMKNK1
SCHEMBL1051240 0.81 FYN (0.71) NTRK1NTRK3NTRK2FYNMKNK1
SCHEMBL3021153 0.80 NTRK1 (0.69) NTRK1NTRK3NTRK2FYNMKNK1
SCHEMBL2905622 0.79 FYN (0.72) NTRK1FYN
Hydrochloric Acid SCHEMBL1202037 0.78 FYN (0.71) NTRK1FYN

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-20110046127-A1 Imidazopyridazines for Use as Protein Kinase Inhibitors CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS (CNIO) (ES) 2011-02-24 US disclosed
EP-2217601-A1 IMIDAZOPYRIDAZINES FOR USE AS PROTEIN KINASE INHIBITORS Centro Nacional de Investigaciones Oncológicas (CNIO) (ES) 2010-08-18 EP disclosed
WO-2009060197-A1 IMIDAZOPYRIDAZINES FOR USE AS PROTEIN KINASE INHIBITORS CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS (CNIO) (ES) 2009-05-14 WO 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-20110046127-A1 Imidazopyridazines for Use as Protein Kinase Inhibitors PIM1, PIM3, PIM2 NTRK1 755/4885NTRK3 756/4885NTRK2 2000/4885

“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.