SCHEMBL5909117

SCHEMBL5909117

Cc1ccc(C(=O)N2CC[C@@H](NC(=O)O)C2)cn1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
CCNK O75909 3/20 0.50
CDK12 Q9NYV4 3/20 0.50
KMT2A Q03164 3/20 0.49
MEN1 O00255 1/20 0.49
GRM5 P41594 5/20 0.48
PDE2A O00408 1/20 0.47
VNN1 O95497 1/20 0.46
KDM5A P29375 1/20 0.46
PDE4B Q07343 1/20 0.45

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
SCHEMBL5909284 0.92 VNN1 (0.53) ALDH1A1LMNACCNKCDK12KMT2A
SCHEMBL5909080 0.92 VNN1 (0.53) ALDH1A1LMNACCNKCDK12KMT2A
SCHEMBL5747586 0.90 ALDH1A1 (0.50) ALDH1A1LMNACCNKCDK12KMT2A
SCHEMBL5748313 0.90 ALDH1A1 (0.50) ALDH1A1LMNACCNKCDK12KMT2A
SCHEMBL5746938 0.88 ALDH1A1 (0.53) ALDH1A1LMNACCNKCDK12KMT2A
SCHEMBL3867365 0.88 ALDH1A1 (0.51) ALDH1A1LMNACCNKCDK12KMT2A
SCHEMBL3862880 0.88 ALDH1A1 (0.53) ALDH1A1LMNACCNKCDK12KMT2A
SCHEMBL5746443 0.88 ALDH1A1 (0.51) ALDH1A1LMNACCNKCDK12KMT2A
SCHEMBL3861404 0.87 ALDH1A1 (0.55) ALDH1A1LMNACCNKCDK12KMT2A
SCHEMBL3856964 0.87 ALDH1A1 (0.53) ALDH1A1LMNAKMT2AMEN1GRM5

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 ALDH1A1 206/4885LMNA 3306/4885CCNK 99/4885
US-20060030557-A1 Substituted pyridines having antiangiogenic activity FLT4, KDR, FLT1 ALDH1A1 424/4885LMNA 3161/4885CCNK 101/4885

“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.