SCHEMBL4196489

SCHEMBL4196489

CCC(C)c1c(NCC(F)(F)F)nc(-n2cccn2)nc1S(C)(=O)=O

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 6/20 0.37
CCNE1 P24864 1/20 0.33
CDK2 P24941 1/20 0.33
POLB P06746 1/20 0.30

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
SCHEMBL4192282 0.84 ADORA2A (0.39) ADORA2A
SCHEMBL4202692 0.84 ADORA2A (0.39) ADORA2A
SCHEMBL4189572 0.83 ADORA2A (0.41) ADORA2A
SCHEMBL4199549 0.83 ADORA2A (0.39) ADORA2A
SCHEMBL4199543 0.83 ADORA2A (0.39) ADORA2ACCNE1CDK2
SCHEMBL4953687 0.82 ADORA2A (0.38) ADORA2A
SCHEMBL4199532 0.82 ADORA2A (0.38) ADORA2ACCNE1CDK2
SCHEMBL4196154 0.80 ADORA2A (0.39) ADORA2A
SCHEMBL4189250 0.80 ADORA2A (0.39) ADORA2A
SCHEMBL4194810 0.77 ADORA2A (0.39) ADORA2A

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-20090042917-A1 Aminopyrimidine Derivative and Plant Disease Control Agent for Agricultural or Horticultural Use KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2009-02-12 US disclosed
EP-2006288-A1 AMINOPYRIDINE DERIVATIVE AND PLANT DISEASE CONTROL AGENT FOR AGRICULTURAL OR HORTICULTURAL USE KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2008-12-24 EP 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-20090042917-A1 Aminopyrimidine Derivative and Plant Disease Control Agent for Agricultural or Horticultural Use DPYD, PM20D2, PDCD11 ADORA2A 608/4885CCNE1 755/4885CDK2 307/4885

“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.