SCHEMBL2633263

SCHEMBL2633263

CN1CCC(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)CC1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.69
TDP1 Q9NUW8 1/20 0.69
ALDH1A1 P00352 2/20 0.65
MAPK1 P28482 1/20 0.58
CAPN1 P07384 2/20 0.57
POLB P06746 2/20 0.55
HSD17B10 Q99714 1/20 0.55
PSMB5 P28074 1/20 0.52
ADORA2A P29274 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.51
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51

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
SCHEMBL9716658 0.87 LMNA (0.82) LMNATDP1ALDH1A1CAPN1POLB
SCHEMBL31390220 0.87 LMNA (0.82) LMNATDP1ALDH1A1CAPN1POLB
SCHEMBL9716661 0.87 LMNA (0.82) LMNATDP1ALDH1A1CAPN1POLB
SCHEMBL9556460 0.87 ADORA2A (0.58) LMNATDP1ALDH1A1MAPK1ADORA2A
SCHEMBL5612699 0.85 LMNA (0.73) LMNATDP1ALDH1A1HSD17B10PSMB5
SCHEMBL9234559 0.85 LMNA (0.73) LMNATDP1ALDH1A1HSD17B10PSMB5
SCHEMBL10665563 0.85 LMNA (0.73) LMNATDP1ALDH1A1HSD17B10PSMB5
SCHEMBL9232060 0.84 LMNA (0.76) LMNATDP1ALDH1A1MAPK1HSD17B10
SCHEMBL9232064 0.84 LMNA (0.76) LMNATDP1ALDH1A1MAPK1HSD17B10
SCHEMBL7778087 0.83 LMNA (0.71) LMNATDP1ALDH1A1HSD17B10PSMB5

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-20120101026-A1 Compounds For Enzyme Inhibition ONYX THERAPEUTICS, INC. (US) 2012-04-26 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-20120101026-A1 Compounds For Enzyme Inhibition ANPEP, DNPEP, CPN1 LMNA 3012/4885TDP1 1175/4885ALDH1A1 3059/4885

“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.