SCHEMBL6134411

SCHEMBL6134411

Cc1ccc(-c2nc(N)ncc2-c2ccc(=O)[nH]n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.56
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
RPS6KA3 P51812 1/20 0.49
ADORA1 P30542 10/20 0.44
ADORA2A P29274 6/20 0.41
CYP1A2 P05177 1/20 0.38
PDE3B Q13370 2/20 0.37
PDE3A Q14432 2/20 0.37
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
ADORA2B P29275 1/20 0.37
HTT P42858 1/20 0.36
GPR55 Q9Y2T6 1/20 0.36

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
SCHEMBL6133854 0.87 LMNA (0.46) LMNAKMT2AMEN1ADORA1ADORA2A
SCHEMBL6133777 0.87 ADORA1 (0.41) LMNAKMT2AMEN1RPS6KA3ADORA1
SCHEMBL6133302 0.87 CYP1A2 (0.54) KMT2AADORA1ADORA2ACYP1A2
SCHEMBL6133724 0.86 KMT2A (0.64) LMNAKMT2AMEN1ADORA1ADORA2A
SCHEMBL6133973 0.86 ADORA1 (0.55) LMNAKMT2AMEN1ADORA1ADORA2A
SCHEMBL6133379 0.85 ADORA1 (0.58) LMNAKMT2AMEN1RPS6KA3ADORA1
SCHEMBL6134600 0.82 FGFR1 (0.42) LMNAKMT2AMEN1ADORA1ADORA2A
SCHEMBL6134045 0.81 RPS6KA3 (0.44) LMNAKMT2AMEN1RPS6KA3ADORA1
SCHEMBL6133477 0.81 ADORA1 (0.55) LMNAKMT2AMEN1ADORA1ADORA2A
SCHEMBL6133656 0.81 PDE4A (0.62) LMNAKMT2AMEN1ADORA1ADORA2A

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 LMNA 3549/4885KMT2A 1769/4885MEN1 4671/4885

“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.