SCHEMBL8576395

SCHEMBL8576395

C[C@H](NC(=O)C(C)(C)N)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.37
RAB9A P51151 1/20 0.37
ACE P12821 1/20 0.37
CPA1 P15085 1/20 0.37
ACE2 Q9BYF1 1/20 0.37
CA2 P00918 5/20 0.36
CA1 P00915 4/20 0.36
PRCP P42785 2/20 0.35
ALDH1A1 P00352 4/20 0.33
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
PTGS1 P23219 1/20 0.33
MEN1 O00255 1/20 0.33
TSHR P16473 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL8576390 1.00 MME (0.37) MMERAB9AACECPA1ACE2
SCHEMBL24709572 0.82 PRCP (0.32) PRCP
SCHEMBL13127956 0.82 PRCP (0.32) PRCP
SCHEMBL22251624 0.81 MME (0.39) MMERAB9AACECPA1ACE2
SCHEMBL2863541 0.81 MME (0.39) MMERAB9AACECPA1ACE2
SCHEMBL2863543 0.81 MME (0.39) MMERAB9AACECPA1ACE2
SCHEMBL3468812 0.78 SMN1; SMN2 (0.41) CA2CA1PRCPALDH1A1MAPT
SCHEMBL15235415 0.78 SIGMAR1 (0.38) RAB9ACA2CA1PRCPALDH1A1
SCHEMBL22092480 0.77 SMN1; SMN2 (0.38) MMERAB9AACECPA1ACE2
SCHEMBL29538486 0.77 CA2 (0.41) MMECA2CA1PRCPALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240360179-A1 STAPLED PEPTIDES AND METHODS THEREOF PARABILIS MEDICINES, INC. 2024-10-31 US disclosed
US-5840712-A TARGETS AND LINKERS RECEPTAGEN CORPORATION (US) 1998-11-24 US disclosed
US-5739287-A BOUND ALSO TO A RECEPTOR MODULATING AGENT TO IMPEDE CELL SURFACE RECEPTOR TRAFFICKING PATHWAYS BY INHIBITING THE RECYCLING OF RECEPTORS TO THE CELL SURFACE; ANTITUMOR AND -CARCINOGENIC AGENTS; LEUKEMIA UNIVERSITY OF WASHINGTON (US) 1998-04-14 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-20240360179-A1 STAPLED PEPTIDES AND METHODS THEREOF CTNNB1, APC, CTNNA1 MME 479/4885RAB9A 1709/4885ACE 898/4885

“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.