SCHEMBL6134466

SCHEMBL6134466

CC(C)n1nc(-c2cnc(N)nc2-c2cccc(O)c2)ccc1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 10/20 0.53
PIK3CD O00329 5/20 0.46
PIK3CB P42338 4/20 0.46
PIK3CG P48736 4/20 0.46
PIK3CA P42336 3/20 0.46
PRKDC P78527 3/20 0.46
ABL1 P00519 2/20 0.46
EGFR P00533 2/20 0.46
HCK P08631 2/20 0.46
SRC P12931 2/20 0.46
KDR P35968 2/20 0.46
MTOR P42345 2/20 0.46
EPHB4 P54760 2/20 0.46
PI4KB Q9UBF8 2/20 0.46
ADORA2A P29274 8/20 0.42
GFER P55789 1/20 0.41
KMT2A Q03164 1/20 0.41
HRH3 Q9Y5N1 1/20 0.39
MAPT P10636 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL6133385 0.88 ADORA1 (0.54) ADORA1SRCADORA2AMAPTADORA2B
SCHEMBL6133581 0.88 ADORA1 (0.49) ADORA1PIK3CDPIK3CBPIK3CGPIK3CA
SCHEMBL6133985 0.88 ADORA1 (0.40) ADORA1ADORA2AKMT2AHRH3MAPT
SCHEMBL6134132 0.88 ADORA1 (0.41) ADORA1ADORA2AADORA2B
SCHEMBL6134599 0.88 ADORA1 (0.53) ADORA1SRCADORA2ALMNAADORA2B
SCHEMBL6134324 0.87 ADORA1 (0.47) ADORA1ADORA2AKMT2AADORA2B
SCHEMBL6133436 0.86 ADORA1 (0.56) ADORA1PIK3CBPIK3CGPIK3CAADORA2A
SCHEMBL6134637 0.86 ADORA2A (0.56) ADORA1PIK3CDPIK3CBPIK3CGPIK3CA
SCHEMBL6134489 0.85 ADORA1 (0.55) ADORA1PIK3CDPIK3CGPIK3CAABL1
SCHEMBL6134331 0.85 ADORA1 (0.45) ADORA1PIK3CDPIK3CBPIK3CGPIK3CA

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-20050043315-A1 Aminopyrimidine compounds, processes for their preparation and pharmaceutical compositions containing them ASTELLAS PHARMA INC. (JP) 2005-02-24 US disclosed
WO-2003057689-A1 AMINOPYRIMIDINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-07-17 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-20050043315-A1 Aminopyrimidine compounds, processes for their preparation and pharmaceutical compositions containing them ADORA2B, ADORA2A, ADORA1 ADORA1 3/4885PIK3CD 1667/4885PIK3CB 2136/4885

“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.