SCHEMBL5909239

SCHEMBL5909239

CN(C)[C@@H]1CCN(C(=O)c2cccnc2Oc2ccccc2)C1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
TDP1 Q9NUW8 1/20 0.50
BTK Q06187 1/20 0.47
ALDH1A1 P00352 3/20 0.47
CYP3A4 P08684 1/20 0.45
UGCG Q16739 1/20 0.45
LMNA P02545 1/20 0.44
MAPK8 P45983 1/20 0.44
GAA P10253 1/20 0.43

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
SCHEMBL25883279 0.78 TDP1 (0.54) POLBTDP1ALDH1A1MAPK8
SCHEMBL4123313 0.76 SLC6A2 (0.48) POLBTDP1ALDH1A1CYP3A4UGCG
SCHEMBL1809257 0.74 POLB (0.65) POLBTDP1
SCHEMBL15949379 0.73 ALDH1A1 (0.59) POLBTDP1ALDH1A1
SCHEMBL10293555 0.73 L3MBTL3 (0.69)
SCHEMBL10293598 0.73 L3MBTL3 (0.69)
SCHEMBL2143867 0.72 ALDH1A1 (0.49) ALDH1A1
SCHEMBL13696799 0.72 USP30 (0.49) POLBTDP1MAPK8
SCHEMBL6202647 0.72 L3MBTL3 (0.67) POLBGAA
SCHEMBL5909215 0.72 L3MBTL3 (0.67) POLBGAA

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-20060030557-A1 Substituted pyridines having antiangiogenic activity HAVIV FORTUNA 2006-02-09 US disclosed
US-20040014744-A1 Substituted pyridines having antiangiogenic activity ABBOTT LABORATORIES 2004-01-22 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 (2 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-20040014744-A1 Substituted pyridines having antiangiogenic activity FLT1, FLT4, KDR POLB 1000/4885TDP1 2129/4885BTK 2494/4885
US-20060030557-A1 Substituted pyridines having antiangiogenic activity FLT4, KDR, FLT1 POLB 832/4885TDP1 2833/4885BTK 2293/4885

“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.