SCHEMBL13503286

SCHEMBL13503286

CC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.57
ALDH1A1 P00352 1/20 0.56
ALOX15 P16050 1/20 0.56
CTSK P43235 7/20 0.55
MME P08473 1/20 0.54
ECE1 P42892 1/20 0.54
CTSL P07711 4/20 0.53
SIRT2 Q8IXJ6 1/20 0.53
CTSS P25774 2/20 0.51
CTSB P07858 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
SCHEMBL11153005 0.92 CTSL (0.61) SMN1; SMN2CTSKMMEECE1CTSL
SCHEMBL10192703 0.90 KYNU (0.58) SMN1; SMN2ALDH1A1ALOX15CTSKMME
SCHEMBL10074198 0.90 KYNU (0.58) SMN1; SMN2ALDH1A1ALOX15CTSKMME
SCHEMBL2083704 0.90 KYNU (0.58) SMN1; SMN2ALDH1A1ALOX15CTSKMME
SCHEMBL716988 0.89 MME (0.65) SMN1; SMN2CTSKMMEECE1SIRT2
SCHEMBL10192704 0.89 MME (0.65) SMN1; SMN2CTSKMMEECE1SIRT2
SCHEMBL29682481 0.89 MME (0.56) SMN1; SMN2CTSKMMEECE1CTSL
SCHEMBL716987 0.89 MME (0.65) SMN1; SMN2CTSKMMEECE1SIRT2
SCHEMBL4919347 0.89 MME (0.56) SMN1; SMN2CTSKMMEECE1CTSL
SCHEMBL28993693 0.89 MME (0.56) SMN1; SMN2CTSKMMEECE1CTSL

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-20100029636-A1 Lck inhibitors NOVARTIS AG (CH) 2010-02-04 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-20100029636-A1 Lck inhibitors LCK, ZAP70, FYN SMN1; SMN2 3267/4885ALDH1A1 4236/4885ALOX15 3896/4885

“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.