SCHEMBL6133488

SCHEMBL6133488

NC(=O)c1cn(C[C@H](CCCc2cccc3cc(Cl)ccc23)OCc2ccccc2)cn1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADA P00813 11/20 0.43
PTGER1 P34995 5/20 0.37
MCL1 Q07820 2/20 0.35
ACLY P53396 1/20 0.35

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
SCHEMBL6133578 0.94 ADA (0.43) ADAPTGER1MCL1
SCHEMBL6169584 0.91 ADA (0.52) ADA
SCHEMBL6170057 0.88 ADA (0.51) ADA
SCHEMBL6171261 0.85 ADA (0.44) ADAPTGER1
SCHEMBL6172589 0.85 ADA (0.49) ADAPTGER1
SCHEMBL6133239 0.84 ADA (0.47) ADAMCL1
SCHEMBL7667851 0.84 ADA (0.42) ADAMCL1
SCHEMBL6169457 0.82 ADA (0.49) ADA
SCHEMBL6171160 0.82 ADA (0.44) ADAPTGER1
SCHEMBL6172230 0.81 ADA (0.42) ADAPTGER1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6908940-B2 Imidazole compounds and their use as adenosine deaminase inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-06-21 US claimed
US-6908940-B2 Imidazole compounds and their use as adenosine deaminase inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-06-21 US disclosed
US-20040097571-A1 Imidazole compounds and their use as adenosine deaminase inhibitors ASTELLAS PHARMA INC. (JP) 2004-05-20 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-20040097571-A1 Imidazole compounds and their use as adenosine deaminase inhibitors ADA, AMPD2, AMPD1 ADA 1/4885PTGER1 1527/4885MCL1 1137/4885

“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.