SCHEMBL6133848

SCHEMBL6133848

CC(=O)Sc1nc(N)nc(-c2ccccc2)c1-c1ccc(=O)n(C(C)C)n1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 15/20 0.39
ADORA1 P30542 15/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.35
RET P07949 1/20 0.34
CSF1R P07333 1/20 0.34
FGFR1 P11362 1/20 0.34
FLT1 P17948 1/20 0.34
KDR P35968 1/20 0.34
CSNK1A1 P48729 1/20 0.34
CDK8 P49336 1/20 0.34
GSK3A P49840 1/20 0.34
GSK3B P49841 1/20 0.34
CDK5 Q00535 1/20 0.34
PRKCQ Q04759 1/20 0.34
LRRK2 Q5S007 1/20 0.34
CLK4 Q9HAZ1 1/20 0.34
DYRK1B Q9Y463 1/20 0.34

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
SCHEMBL6133889 0.87 ADORA2A (0.42) ADORA2AADORA1TP53
SCHEMBL6134904 0.85 ADORA2A (0.42) ADORA2AADORA1TP53
SCHEMBL6134022 0.84 ADORA2A (0.45) ADORA2AADORA1TP53POLB
SCHEMBL6134544 0.82 ADORA2A (0.46) ADORA2AADORA1TP53
SCHEMBL6134523 0.82 ADORA2A (0.45) ADORA2AADORA1TP53POLB
SCHEMBL6133734 0.82 ADORA2A (0.45) ADORA2AADORA1TP53
SCHEMBL6134002 0.79 ADORA2A (0.37) ADORA2AADORA1TP53CSF1RFGFR1
SCHEMBL6135237 0.79 ADORA2A (0.42) ADORA2AADORA1TP53POLB
SCHEMBL6133778 0.79 ADORA2A (0.42) ADORA2AADORA1TP53
SCHEMBL6133453 0.79 ADORA2A (0.42) ADORA2AADORA1TP53

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 1 patent. 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

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 ADORA2A 2/4885ADORA1 3/4885TP53 2834/4885

“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.