SCHEMBL1783370

SCHEMBL1783370

CCn1cc(N=C=S)cn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY6 Q15077 1/20 0.38
KMT2A Q03164 1/20 0.35
MIF P14174 1/20 0.33
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
MAPT P10636 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
PDK2 Q15119 1/20 0.30
LMNA P02545 1/20 0.30
CYP2C19 P33261 1/20 0.30
GFER P55789 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
PIK3CD O00329 1/20 0.30
PIK3CA P42336 1/20 0.30
PIK3CB P42338 1/20 0.30
PI4KA P42356 1/20 0.30
PIK3CG P48736 1/20 0.30

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
SCHEMBL24907425 0.75
SCHEMBL293672 0.65
SCHEMBL7459363 0.63
SCHEMBL1581682 0.63
SCHEMBL15490716 0.63
SCHEMBL11974017 0.63
SCHEMBL670881 0.63
SCHEMBL17459858 0.63
SCHEMBL2756556 0.63
SCHEMBL7459149 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2435443-B1 AMINOPYRAZOLE TRIAZOLOTHIADIAZOLE INHIBITORS OF C-MET PROTIEN KINASE VERTEX PHARMA (US) 2013-07-31 EP disclosed
EP-2435443-B1 AMINOPYRAZOLE TRIAZOLOTHIADIAZOLE INHIBITORS OF C-MET PROTIEN KINASE VERTEX PHARMA (US) 2013-07-31 EP disclosed
US-20130018072-A1 AMINOPYRAZOLE TRIAZOLOTHIADIAZOLE INHIBITORS OF C-MET PROTEIN KINASE VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-01-17 US disclosed
US-20130018072-A1 AMINOPYRAZOLE TRIAZOLOTHIADIAZOLE INHIBITORS OF C-MET PROTEIN KINASE VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-01-17 US disclosed
US-20130018072-A1 AMINOPYRAZOLE TRIAZOLOTHIADIAZOLE INHIBITORS OF C-MET PROTEIN KINASE VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-01-17 US disclosed
US-8269012-B2 Aminopyrazole triazolothiadiazole inhibitors of c-met protein kinase VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-09-18 US disclosed
US-8269012-B2 Aminopyrazole triazolothiadiazole inhibitors of c-met protein kinase VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-09-18 US disclosed
US-8269012-B2 Aminopyrazole triazolothiadiazole inhibitors of c-met protein kinase VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-09-18 US disclosed
EP-2435443-A1 AMINOPYRAZOLE TRIAZOLOTHIADIAZOLE INHIBITORS OF C-MET PROTIEN KINASE Vertex Pharmaceuticals Incorporated (US) 2012-04-04 EP disclosed
US-20110124684-A1 AMINOPYRAZOLE TRIAZOLOTHIADIAZOLE INHIBITORS OF C-MET PROTIEN KINASE VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-05-26 US disclosed
US-20110124684-A1 AMINOPYRAZOLE TRIAZOLOTHIADIAZOLE INHIBITORS OF C-MET PROTIEN KINASE VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-05-26 US disclosed
US-20110124684-A1 AMINOPYRAZOLE TRIAZOLOTHIADIAZOLE INHIBITORS OF C-MET PROTIEN KINASE VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-05-26 US disclosed
WO-2010138665-A1 AMINOPYRAZOLE TRIAZOLOTHIADIAZOLE INHIBITORS OF C-MET PROTIEN KINASE VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-12-02 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 (2 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-20110124684-A1 AMINOPYRAZOLE TRIAZOLOTHIADIAZOLE INHIBITORS OF C-MET PROTIEN KINASE MET, MELK, DMPK P2RY6 2257/4885KMT2A 950/4885MIF 953/4885
US-20130018072-A1 AMINOPYRAZOLE TRIAZOLOTHIADIAZOLE INHIBITORS OF C-MET PROTEIN KINASE MET, ABL1, DMPK P2RY6 3385/4885KMT2A 764/4885MIF 649/4885

“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.