SCHEMBL6134219

SCHEMBL6134219

COc1ccc(-c2cnc(N)nc2-c2ccc(Br)cc2)nn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.53
MAPT P10636 2/20 0.47
MAPK1 P28482 2/20 0.47
ATM Q13315 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ADORA1 P30542 11/20 0.46
ADORA2A P29274 7/20 0.44
MEN1 O00255 2/20 0.41
RPS6KA3 P51812 1/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
MAPK10 P53779 1/20 0.41
PTK2B Q14289 1/20 0.41
NCOA1 Q15788 1/20 0.41
NCOA3 Q9Y6Q9 1/20 0.41
CLK1 P49759 2/20 0.39
CDK5 Q00535 1/20 0.39
CDK5R1 Q15078 1/20 0.39

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
SCHEMBL6134408 0.88 KMT2A (0.55) KMT2AMAPTMAPK1ADORA1ADORA2A
SCHEMBL6133624 0.88 KMT2A (0.70) KMT2AMAPTMAPK1NPSR1ADORA1
SCHEMBL6135107 0.87 KMT2A (0.53) KMT2AMAPTMAPK1ADORA1ADORA2A
SCHEMBL6133448 0.87 ADORA1 (0.59) KMT2AADORA1ADORA2A
SCHEMBL6133395 0.86 ADORA1 (0.55) KMT2AMAPTMAPK1ADORA1ADORA2A
SCHEMBL6134195 0.85 ADORA1 (0.49) KMT2AMAPTMAPK1ATMNPSR1
SCHEMBL6133429 0.84 KMT2A (0.47) KMT2AMAPTMAPK1ATMNPSR1
SCHEMBL6133571 0.82 ADORA1 (0.56) KMT2AMAPTMAPK1ADORA1ADORA2A
SCHEMBL6133909 0.82 ADORA1 (0.62) KMT2AMAPTMAPK1ATMNPSR1
SCHEMBL6134177 0.82 ADORA1 (0.50) KMT2AMAPTMAPK1ATMNPSR1

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 KMT2A 1769/4885MAPT 1622/4885MAPK1 3570/4885

“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.