SCHEMBL6505524

SCHEMBL6505524

COc1cc(-c2cc3nccn3c(Nc3ncccc3C(N)=O)n2)ccc1N1CCOCC1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K2 Q12851 6/20 0.76
SYK P43405 6/20 0.76
MAP4K4 O95819 2/20 0.76
PKN2 Q16513 2/20 0.76
AURKB Q96GD4 2/20 0.76
SLK Q9H2G2 2/20 0.76
CDC7 O00311 1/20 0.76
PLK4 O00444 1/20 0.76
DYRK3 O43781 1/20 0.76
ROCK2 O75116 1/20 0.76
PRKD3 O94806 1/20 0.76
CDK1 P06493 1/20 0.76
CSF1R P07333 1/20 0.76
MET P08581 1/20 0.76
KIT P10721 1/20 0.76
PHKG2 P15735 1/20 0.76
CDK2 P24941 1/20 0.76
MAPK1 P28482 1/20 0.76
FLT3 P36888 1/20 0.76
CLK2 P49760 1/20 0.76

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
SCHEMBL6508112 0.93 SYK (0.65) MAP4K2SYKMAP4K4PKN2AURKB
SCHEMBL6495254 0.91 MAP4K2 (0.77) MAP4K2SYKMAP4K4PKN2AURKB
SCHEMBL373774 0.87 SYK (1.00) MAP4K2SYKMAP4K4PKN2AURKB
SCHEMBL29359979 0.87 SYK (1.00) MAP4K2SYKMAP4K4PKN2AURKB
Hydrochloric Acid SCHEMBL1224258 0.86 SYK (1.00) MAP4K2SYKMAP4K4PKN2AURKB
Hydrochloric Acid SCHEMBL31094662 0.86 SYK (1.00) MAP4K2SYKMAP4K4PKN2AURKB
Hydrochloric Acid SCHEMBL4075258 0.86 SYK (1.00) MAP4K2SYKMAP4K4PKN2AURKB
SCHEMBL6505192 0.81 SYK (0.51) MAP4K2SYKMAP4K4PKN2AURKB
SCHEMBL6640603 0.81 SYK (0.55) MAP4K2SYKMAP4K4PKN2AURKB
Hydrochloric Acid SCHEMBL6279261 0.81 MAP4K2 (0.88) MAP4K2SYKMAP4K4PKN2AURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6911443-B2 Imidazopyrimidine derivatives and triazolopyrimidine derivatives BAYER AKTIENGESELLSCHAFT (DE) 2005-06-28 US claimed
EP-1278750-B1 IMIDAZOPYRIMIDINE DERIVATIVES AND TRIAZOLOPYRIMIDINE DERIVATIVES BAYER HEALTHCARE AG (DE) 2004-08-04 EP claimed
US-20040054179-A1 Imidazopyrimidine derivatives and triazolopyrimidine derivatives BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2004-03-18 US claimed
EP-1278750-A1 IMIDAZOPYRIMIDINE DERIVATIVES AND TRIAZOLOPYRIMIDINE DERIVATIVES Bayer Aktiengesellschaft (DE) 2003-01-29 EP claimed
WO-2001083485-A1 IMIDAZOPYRIMIDINE DERIVATIVES AND TRIAZOLOPYRIMIDINE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2001-11-08 WO claimed
US-6911443-B2 Imidazopyrimidine derivatives and triazolopyrimidine derivatives BAYER AKTIENGESELLSCHAFT (DE) 2005-06-28 US disclosed
EP-1278750-B1 IMIDAZOPYRIMIDINE DERIVATIVES AND TRIAZOLOPYRIMIDINE DERIVATIVES BAYER HEALTHCARE AG (DE) 2004-08-04 EP disclosed
US-20040054179-A1 Imidazopyrimidine derivatives and triazolopyrimidine derivatives BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2004-03-18 US disclosed
EP-1278750-A1 IMIDAZOPYRIMIDINE DERIVATIVES AND TRIAZOLOPYRIMIDINE DERIVATIVES Bayer Aktiengesellschaft (DE) 2003-01-29 EP disclosed
WO-2001083485-A1 IMIDAZOPYRIMIDINE DERIVATIVES AND TRIAZOLOPYRIMIDINE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2001-11-08 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-20040054179-A1 Imidazopyrimidine derivatives and triazolopyrimidine derivatives XRCC6, XRN2, HRH2 MAP4K2 2126/4885SYK 1025/4885MAP4K4 2194/4885

“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.