SCHEMBL4349807

SCHEMBL4349807

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nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 8/20 0.33
AHCY P23526 5/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ADORA1 P30542 7/20 0.33
ADORA2A P29274 3/20 0.33
P2RY1 P47900 3/20 0.32
TMIGD3 P0DMS9 2/20 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
SCHEMBL4350570 0.88 ADORA3 (0.47) ADORA3ADORA1ADORA2AP2RY1TMIGD3
SCHEMBL4350587 0.86 AHCY (0.43) AHCY
SCHEMBL1401951 0.86 LMNA (0.41) ADORA3AHCYALDH1A1LMNATP53
SCHEMBL12003121 0.86 LMNA (0.41) ADORA3AHCYALDH1A1LMNATP53
SCHEMBL3714471 0.86 LMNA (0.41) ADORA3AHCYALDH1A1LMNATP53
SCHEMBL239127 0.86 LMNA (0.41) ADORA3AHCYALDH1A1LMNATP53
SCHEMBL8960068 0.86 LMNA (0.41) ADORA3AHCYALDH1A1LMNATP53
SCHEMBL1401952 0.86 LMNA (0.41) ADORA3AHCYALDH1A1LMNATP53
SCHEMBL4349829 0.82 ABCB1 (0.32) ADORA3ALDH1A1LMNATP53MAPT
SCHEMBL242481 0.81 LMNA (0.40) ADORA3ALDH1A1LMNATP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090281126-A1 Organic Compounds NOVARTIS AG 2009-11-12 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-20090281126-A1 Organic Compounds CYP3A43, CYP3A4, CYP2C19 ADORA3 732/4885AHCY 4831/4885ALDH1A1 86/4885

“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.