SCHEMBL1932082

SCHEMBL1932082

COc1ccc(F)cc1Nc1nc2ccc(-c3cc(C)c(O)c(C)c3)cn2n1

nearest known ligand 0.79

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TTK P33981 15/20 0.79
LRRK2 Q5S007 3/20 0.64
PIK3CD O00329 2/20 0.54
PIK3CA P42336 2/20 0.54
PIK3CG P48736 2/20 0.54
PIK3CB P42338 1/20 0.54
JAK2 O60674 1/20 0.50
KIT P10721 1/20 0.47
MTOR P42345 1/20 0.47
MAPK8 P45983 1/20 0.47
MAPK9 P45984 1/20 0.47
MAPK10 P53779 1/20 0.47
STK38 Q15208 1/20 0.47
BRSK2 Q8IWQ3 1/20 0.47
MINK1 Q8N4C8 1/20 0.47
PIP4K2C Q8TBX8 1/20 0.47
MAP4K1 Q92918 1/20 0.47

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
SCHEMBL12506952 0.90 TTK (0.79) TTKLRRK2PIK3CDPIK3CAPIK3CG
SCHEMBL2187497 0.89 TTK (0.77) TTKLRRK2PIK3CDPIK3CAPIK3CG
SCHEMBL1933243 0.89 TTK (1.00) TTKLRRK2PIK3CDPIK3CAPIK3CG
SCHEMBL12553565 0.88 TTK (0.76) TTKLRRK2PIK3CDPIK3CAPIK3CG
SCHEMBL2186456 0.85 TTK (0.72) TTKLRRK2PIK3CDPIK3CAPIK3CG
SCHEMBL12507202 0.83 TTK (0.79) TTKLRRK2PIK3CDPIK3CAPIK3CG
SCHEMBL2185756 0.82 TTK (0.77) TTKLRRK2PIK3CDPIK3CAPIK3CG
SCHEMBL12553755 0.82 TTK (0.76) TTKLRRK2PIK3CDPIK3CAPIK3CG
SCHEMBL1933539 0.80 TTK (0.73) TTKLRRK2PIK3CDPIK3CAPIK3CG
SCHEMBL1932796 0.80 TTK (0.63) TTKPIK3CDPIK3CAPIK3CGKIT

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-2507236-B1 Triazolopyridine derivates BAYER IP GMBH (DE) 2014-12-17 EP claimed
US-20130121994-A1 TRIAZOLOPYRIDINE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-05-16 US claimed
EP-2507236-A1 TRIAZOLOPYRIDINE DERIVATIVES Bayer Intellectual Property GmbH (DE) 2012-10-10 EP claimed
EP-2343295-A1 Triazolopyridine derivates Bayer Schering Pharma AG (DE) 2011-07-13 EP claimed
WO-2011064328-A1 TRIAZOLOPYRIDINE DERIVATIVES BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-06-03 WO claimed
EP-2507236-B1 Triazolopyridine derivates BAYER IP GMBH (DE) 2014-12-17 EP disclosed
EP-2507236-B1 Triazolopyridine derivates BAYER IP GMBH (DE) 2014-12-17 EP disclosed
US-20130121994-A1 TRIAZOLOPYRIDINE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-05-16 US disclosed
US-20130121994-A1 TRIAZOLOPYRIDINE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-05-16 US disclosed
US-20130121994-A1 TRIAZOLOPYRIDINE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-05-16 US disclosed
EP-2343295-A1 Triazolopyridine derivates Bayer Schering Pharma AG (DE) 2011-07-13 EP disclosed
WO-2011064328-A1 TRIAZOLOPYRIDINE DERIVATIVES BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-06-03 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-20130121994-A1 TRIAZOLOPYRIDINE DERIVATIVES TTBK1, BUB1, TTK TTK 3/4885LRRK2 1012/4885PIK3CD 430/4885

“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.