SCHEMBL6133980

SCHEMBL6133980

CC(C)n1nc(-c2cnc(N)nc2-c2c(F)cccc2F)ccc1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 7/20 0.35
ADORA2A P29274 6/20 0.35
ADORA2B P29275 4/20 0.35
FGFR1 P11362 2/20 0.35
PDGFRB P09619 1/20 0.35
SRC P12931 1/20 0.35
PDGFRA P16234 1/20 0.35
ADORA3 P0DMS8 1/20 0.33
PIM1 P11309 1/20 0.33
PIM3 Q86V86 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
FGFR2 P21802 1/20 0.32
FGFR3 P22607 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
BTK Q06187 1/20 0.32
RPS6KA3 P51812 1/20 0.32
MDM2 Q00987 2/20 0.32
HDAC1 Q13547 1/20 0.32
BRAF P15056 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL6134468 0.89 ADORA2A (0.37) ADORA1ADORA2AADORA2BADORA3HDAC1
SCHEMBL6134198 0.89 FGFR1 (0.39) ADORA1ADORA2AADORA2BFGFR1PDGFRB
SCHEMBL6134889 0.87 FGFR1 (0.42) ADORA1ADORA2AADORA2BFGFR1PDGFRB
SCHEMBL6135304 0.85 ADORA1 (0.40) ADORA1ADORA2AADORA2BFGFR1SRC
SCHEMBL6134132 0.84 ADORA1 (0.41) ADORA1ADORA2AADORA2B
SCHEMBL6133788 0.83 ADORA1 (0.39) ADORA1ADORA2AADORA2BFGFR1PDGFRB
SCHEMBL6134450 0.83 ADORA1 (0.50) ADORA1ADORA2AADORA2BADORA3HRH3
SCHEMBL6134324 0.83 ADORA1 (0.47) ADORA1ADORA2AADORA2B
SCHEMBL6134359 0.83 RPS6KA3 (0.42) ADORA1ADORA2AADORA2BFGFR1SRC
SCHEMBL6134252 0.81 ADORA2A (0.38) ADORA1ADORA2AADORA2BFGFR1PDGFRB

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 3/4885ADORA2A 2/4885ADORA2B 1/4885

“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.