SCHEMBL6479012

SCHEMBL6479012

Nc1nc2ccccc2n1-c1ncnc(Nc2cccc(Cn3ccnn3)c2)n1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 10/20 0.47
MTOR P42345 10/20 0.47
KDR P35968 3/20 0.41
PIK3CD O00329 2/20 0.41
PIK3CB P42338 2/20 0.41
PIK3CG P48736 2/20 0.41
RAF1 P04049 1/20 0.41
BRAF P15056 1/20 0.41
TGFBR2 P37173 1/20 0.41
CSNK1D P48730 1/20 0.41
LCK P06239 2/20 0.41
MAPK14 Q16539 2/20 0.41
CYP19A1 P11511 2/20 0.39
CCNT1 O60563 3/20 0.38
CDK9 P50750 3/20 0.38
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
SCN9A Q15858 1/20 0.35
VCP P55072 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
SCHEMBL6478557 0.89 PIK3CA (0.47) PIK3CAMTORKDRPIK3CDPIK3CB
SCHEMBL6479199 0.79 PIK3CA (0.52) PIK3CAMTORKDRPIK3CDPIK3CB
SCHEMBL6479294 0.77 CYP19A1 (0.48) KDRCSNK1DLCKCYP19A1JAK2
SCHEMBL6490189 0.76 CYP19A1 (0.44) KDRCYP19A1JAK2JAK1
SCHEMBL14214732 0.75 SCN9A (0.59) PIK3CAMTORPIK3CDPIK3CBPIK3CG
SCHEMBL6479848 0.74 PIK3CA (0.54) PIK3CAMTORKDRPIK3CDPIK3CB
SCHEMBL14214693 0.72 FGFR2 (0.42) KDRCSNK1DCYP19A1CCNT1CDK9
SCHEMBL14214617 0.72 KDR (0.53) PIK3CAMTORKDRLCKMAPK14
SCHEMBL14214621 0.70 KDR (0.57) PIK3CAMTORKDRPIK3CDPIK3CB
SCHEMBL6485821 0.69 PIK3CA (0.52) PIK3CAMTORKDRPIK3CDPIK3CB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6864255-B2 Substituted triazinyl amide derivatives and methods of use AMGEN INC. (US) 2005-03-08 US disclosed
US-20030087908-A1 Substituted triazinyl amide derivatives and methods of use AMGEN INC. 2003-05-08 US 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-20030087908-A1 Substituted triazinyl amide derivatives and methods of use FLT4, FLT1, VEGFA PIK3CA 475/4885MTOR 1843/4885KDR 4/4885

“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.