SCHEMBL1933985

SCHEMBL1933985

Cc1cc(-c2ccc3nc(N)nn3c2)ccc1C(=O)NCC(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 9/20 0.42
PIK3CD O00329 7/20 0.42
PIK3CA P42336 5/20 0.42
PIK3CB P42338 3/20 0.42
TTK P33981 6/20 0.41
LRRK2 Q5S007 2/20 0.37
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36
JAK3 P52333 1/20 0.36
RIPK1 Q13546 1/20 0.36

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
SCHEMBL1933657 0.89 PIK3CG (0.40) PIK3CGPIK3CDPIK3CAPIK3CBRIPK1
SCHEMBL1932812 0.88 PIK3CG (0.40) PIK3CGPIK3CDPIK3CAPIK3CBJAK2
SCHEMBL1932101 0.85 JAK2 (0.44) PIK3CGPIK3CDPIK3CAPIK3CBTTK
SCHEMBL9996747 0.83 TTK (0.57) PIK3CGPIK3CDPIK3CAPIK3CBTTK
SCHEMBL1933524 0.82 PIK3CG (0.50) PIK3CGPIK3CDPIK3CAPIK3CBTTK
SCHEMBL9998764 0.81 MET (0.48) TTKRIPK1
SCHEMBL9998997 0.80 PIK3CG (0.49) PIK3CGPIK3CDPIK3CAPIK3CBTTK
SCHEMBL12553724 0.76 PIK3CG (0.46) PIK3CGPIK3CDPIK3CAPIK3CBTTK
SCHEMBL12554057 0.75 PIK3CG (0.48) PIK3CGPIK3CDPIK3CAPIK3CBTTK
SCHEMBL1931983 0.74 CFTR (0.42) PIK3CGPIK3CDPIK3CAPIK3CBTTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-2507236-A1 TRIAZOLOPYRIDINE DERIVATIVES Bayer Intellectual Property GmbH (DE) 2012-10-10 EP disclosed
WO-2011064328-A1 TRIAZOLOPYRIDINE DERIVATIVES BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-06-03 WO 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 PIK3CG 718/4885PIK3CD 430/4885PIK3CA 320/4885

“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.