SCHEMBL5909232

SCHEMBL5909232

CCNC(=O)[C@@H]1CCCN1C(=O)c1ccc(C)nc1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
VNN1 O95497 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
GRM5 P41594 5/20 0.46
CNR1 P21554 1/20 0.45
CNR2 P34972 1/20 0.45
LMNA P02545 1/20 0.44

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
SCHEMBL5909277 0.84 ALDH1A1 (0.60) ALDH1A1L3MBTL1CNR1CNR2LMNA
SCHEMBL6275232 0.84 ALDH1A1 (0.60) ALDH1A1L3MBTL1CNR1CNR2LMNA
SCHEMBL5909193 0.81 VNN1 (0.52) ALDH1A1VNN1GRM5CNR1CNR2
SCHEMBL5909307 0.81 VNN1 (0.52) ALDH1A1VNN1GRM5CNR1CNR2
SCHEMBL6203421 0.81 VNN1 (0.52) ALDH1A1VNN1GRM5CNR1CNR2
SCHEMBL845338 0.79 RHOC (0.48) ALDH1A1GRM5
SCHEMBL5909226 0.78 GAA (0.63) ALDH1A1VNN1GRM5CNR1CNR2
SCHEMBL5909293 0.78 GAA (0.63) ALDH1A1VNN1GRM5CNR1CNR2
SCHEMBL5909188 0.78 GAA (0.63) ALDH1A1VNN1GRM5CNR1CNR2
SCHEMBL5909196 0.78 VNN1 (0.52) ALDH1A1VNN1L3MBTL1GRM5CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030195195-A1 Substituted pyridines having antiangiogenic activity ABBOTT LABORATORIES 2003-10-16 US claimed
US-20030195192-A1 Nicotinamides having antiangiogenic activity ABBOTT LABORATORIES 2003-10-16 US claimed
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
US-20030195195-A1 Substituted pyridines having antiangiogenic activity ABBOTT LABORATORIES 2003-10-16 US disclosed
US-20030195192-A1 Nicotinamides having antiangiogenic activity ABBOTT LABORATORIES 2003-10-16 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 (4 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 ALDH1A1 206/4885VNN1 2897/4885L3MBTL1 4650/4885
US-20030195195-A1 Substituted pyridines having antiangiogenic activity FLT1, FLT4, KDR ALDH1A1 206/4885VNN1 2897/4885L3MBTL1 4650/4885
US-20060030557-A1 Substituted pyridines having antiangiogenic activity FLT4, KDR, FLT1 ALDH1A1 424/4885VNN1 2577/4885L3MBTL1 4745/4885
US-20030195192-A1 Nicotinamides having antiangiogenic activity NAMPT, NNT, SIRT1 ALDH1A1 148/4885VNN1 141/4885L3MBTL1 4738/4885

“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.