SCHEMBL6133321

SCHEMBL6133321

CSc1ccccc1CCC[C@@H](Cn1cnc(C(N)=O)c1)OCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADA P00813 11/20 0.42
LPAR1 Q92633 1/20 0.34
TBXAS1 P24557 2/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PTGER4 P35408 1/20 0.32
PTGER3 P43115 1/20 0.32
PTGER2 P43116 1/20 0.32
PTGER1 P34995 1/20 0.31

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
SCHEMBL6171160 0.88 ADA (0.44) ADALPAR1TBXAS1PTGER4PTGER3
SCHEMBL6169457 0.87 ADA (0.49) ADALPAR1TBXAS1KMT2A
SCHEMBL6173997 0.86 ADA (0.42) ADALPAR1TBXAS1KMT2APTGER4
SCHEMBL6172230 0.86 ADA (0.42) ADALPAR1TBXAS1PTGER4PTGER3
SCHEMBL6169584 0.85 ADA (0.52) ADAMEN1KMT2A
SCHEMBL6172528 0.84 ADA (0.42) ADALPAR1
SCHEMBL6173056 0.84 ADA (0.44) ADALPAR1PTGER4PTGER3PTGER2
SCHEMBL6172589 0.84 ADA (0.49) ADALPAR1PTGER1
SCHEMBL6169467 0.84 ADA (0.48) ADALPAR1KMT2A
SCHEMBL1385827 0.83 ADA (0.42) ADALPAR1

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 4 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-20040097571-A1 Imidazole compounds and their use as adenosine deaminase inhibitors ASTELLAS PHARMA INC. (JP) 2004-05-20 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 1/4885LPAR1 3938/4885TBXAS1 540/4885

“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.