SCHEMBL14784591

SCHEMBL14784591

COC1CCN(c2cnc3ccc(OS(=O)(=O)C(F)(F)F)cc3c2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 2/20 0.44
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
CNR1 P21554 2/20 0.43
CNR2 P34972 2/20 0.43
SYK P43405 1/20 0.38
SCN9A Q15858 2/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
PIK3CA P42336 1/20 0.37
HTR3A P46098 1/20 0.36
DRD2 P14416 2/20 0.36
DRD3 P35462 2/20 0.36
CHRM1 P11229 1/20 0.36
DRD4 P21917 1/20 0.36
CES2 O00748 1/20 0.36
MAP4K4 O95819 1/20 0.36
MCHR1 Q99705 1/20 0.36
CHRM4 P08173 1/20 0.36
KCNH2 Q12809 1/20 0.35

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
SCHEMBL12470775 0.87 CNR1 (0.42) METPDE3BPDE3ACNR1CNR2
SCHEMBL14793316 0.87 CNR2 (0.40) METPDE3BPDE3ACNR1CNR2
SCHEMBL12470769 0.85 HTR3A (0.53) METPDE3BPDE3ACA1CA2
SCHEMBL14783394 0.84 MET (0.42) METPDE3BPDE3ACNR1CNR2
SCHEMBL14784218 0.84 MET (0.43) METPDE3BPDE3ACNR1CNR2
SCHEMBL14783729 0.84 HTR3A (0.45) METSCN9ACA1CA2HTR3A
SCHEMBL14793182 0.83 MET (0.45) METPDE3BPDE3ACNR1CNR2
SCHEMBL12470986 0.83 MET (0.45) METPDE3BPDE3ACNR1CNR2
SCHEMBL12470515 0.83 MET (0.45) METPDE3BPDE3ACNR1CNR2
SCHEMBL14783372 0.82 MET (0.41) METPDE3BPDE3ACNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2755976-B1 6-SUBSTITUTED 3-(QUINOLIN-6-YLTHIO)-[1,2,4]TRIAZOLO[4,3-A]PYRIDINES AS C-MET TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2018-07-18 EP disclosed
US-9474762-B2 Triazolopyridine compounds NOVARTIS AG (CH) 2016-10-25 US disclosed
US-9474762-B2 Triazolopyridine compounds NOVARTIS AG (CH) 2016-10-25 US disclosed
US-20150250799-A1 Triazolopyridine Compounds NOVARTIS AG (CH) 2015-09-10 US disclosed
US-20150250799-A1 Triazolopyridine Compounds NOVARTIS AG (CH) 2015-09-10 US disclosed
US-9062045-B2 Triazolopyridine compounds NOVARTIS AG (CH) 2015-06-23 US disclosed
US-9062045-B2 Triazolopyridine compounds NOVARTIS AG (CH) 2015-06-23 US disclosed
EP-2755976-A1 6 - SUBSTITUTED 3 - (QUINOLIN- 6 - YLTHIO) - [1,2,4]TRIAZOLO [4, 3 -A]PYRADINES AS TYROSINE KINASE Novartis AG (CH) 2014-07-23 EP disclosed
US-20130245002-A1 Triazolopyridine Compounds NOVARTIS AG (CH) 2013-09-19 US disclosed
US-20130245002-A1 Triazolopyridine Compounds NOVARTIS AG (CH) 2013-09-19 US disclosed
WO-2013038362-A1 6 - SUBSTITUTED 3 - (QUINOLIN- 6 - YLTHIO) - [1,2,4] TRIAZOLO [4, 3 -A] PYRADINES AS TYROSINE KINASE NOVARTIS AG (CH) 2013-03-21 WO disclosed
WO-2013038362-A1 6 - SUBSTITUTED 3 - (QUINOLIN- 6 - YLTHIO) - [1,2,4] TRIAZOLO [4, 3 -A] PYRADINES AS TYROSINE KINASE NOVARTIS AG (CH) 2013-03-21 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-20150250799-A1 Triazolopyridine Compounds FLT3, RET, MET MET 3/4885PDE3B 608/4885PDE3A 737/4885
US-20130245002-A1 Triazolopyridine Compounds FLT3, RET, MET MET 3/4885PDE3B 608/4885PDE3A 737/4885

“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.