SCHEMBL4813504

SCHEMBL4813504

CC[C@H](NC(=O)[C@H](NC(=O)OCc1ccccc1)c1ccc(O)cc1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.58
CTSS P25774 1/20 0.58
ATM Q13315 1/20 0.56
CTSK P43235 3/20 0.52
KLK1 P06870 1/20 0.50
MME P08473 1/20 0.49
ECE1 P42892 1/20 0.49

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
SCHEMBL5743448 0.88 SYK (0.53) CTSLCTSSATMCTSKKLK1
SCHEMBL5743450 0.88 SYK (0.53) CTSLCTSSATMCTSKKLK1
SCHEMBL5742255 0.84 ATM (0.67) CTSLCTSSATMKLK1
SCHEMBL17765000 0.84 ATM (0.67) CTSLCTSSATMKLK1
SCHEMBL5742261 0.84 ATM (0.67) CTSLCTSSATMKLK1
SCHEMBL265512 0.84 CTSK (0.64) CTSLCTSSCTSK
SCHEMBL319160 0.84 CTSK (0.64) CTSLCTSSCTSK
SCHEMBL2895983 0.84 CTSK (0.64) CTSLCTSSCTSK
SCHEMBL8932367 0.83 CTSL (0.62) CTSLCTSSATMCTSKMME
SCHEMBL19380440 0.81 ATM (0.61) CTSLCTSSATMKLK1

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-7470678-B2 Diphenylazetidinone derivatives for treating disorders of the lipid metabolism ASTRAZENECA AB (SE) 2008-12-30 US disclosed
US-20050239766-A1 Diphenylazetidinone derivatives for treating disorders of the lipid metabolism ASTRAZENECA AB (SE) 2005-10-27 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-20050239766-A1 Diphenylazetidinone derivatives for treating disorders of the lipid metabolism CYP46A1, CYP27A1, CYP7A1 CTSL 2060/4885CTSS 2276/4885ATM 4471/4885

“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.