SCHEMBL22118347

SCHEMBL22118347

CC(C[N+](=O)[O-])C(N)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CPA1 P15085 5/20 0.50
SLC7A5 Q01650 2/20 0.44
SLC1A3 P43003 2/20 0.34
SLC1A2 P43004 2/20 0.34
SLC1A1 P43005 2/20 0.34
USP2 O75604 1/20 0.32
SLCO1B1 Q9Y6L6 1/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
BLM P54132 1/20 0.32
HBB P68871 1/20 0.32
KMT2A Q03164 1/20 0.32
HIF1A Q16665 1/20 0.32
NOS1 P29475 1/20 0.32
ENPEP Q07075 1/20 0.31

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
SCHEMBL22118346 1.00 CPA1 (0.50) CPA1SLC7A5SLC1A3SLC1A2SLC1A1
SCHEMBL26045081 0.83 CPA1 (0.41) CPA1SLC7A5
SCHEMBL30337832 0.79 ALDH1A1 (0.38) CPA1LMNAKMT2A
SCHEMBL27721714 0.78 CPA1 (0.53) CPA1MEN1LMNABLMHBB
Isoleucine SCHEMBL1487682 0.78 SLC7A5 (0.43) CPA1SLC7A5
Isoleucine SCHEMBL1487684 0.78 SLC7A5 (0.43) CPA1SLC7A5
Isoleucine SCHEMBL15641588 0.78 SLC7A5 (0.43) CPA1SLC7A5
SCHEMBL3278706 0.74 CPA1 (0.44) CPA1HIF1A
SCHEMBL28018945 0.73 CPA1 (0.48) CPA1SLC1A3SLC1A2SLC1A1MEN1
SCHEMBL19283821 0.73 CPA1 (0.48) CPA1MEN1LMNABLMHBB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230271945-A1 INHIBITORS OF APOL1 AND METHODS OF USING SAME VERTEX PHARMACEUTICALS INCORPORATED 2023-08-31 US disclosed
US-11618746-B2 Inhibitors of APOL1 and methods of using same VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-04-04 US disclosed
EP-3897833-A1 INHIBITORS OF APOL1 AND METHODS OF USING SAME Vertex Pharmaceuticals Incorporated (US) 2021-10-27 EP disclosed
US-20200377479-A1 INHIBITORS OF APOL1 AND METHODS OF USING SAME Vertex Pharmacéuticals Incorporated 2020-12-03 US disclosed
WO-2020131807-A1 INHIBITORS OF APOL1 AND METHODS OF USING SAME VERTEX PHARMACEUTICALS INCORPORATED (US) 2020-06-25 WO 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 (3 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-20230271945-A1 INHIBITORS OF APOL1 AND METHODS OF USING SAME APOL1, APOB, SAAL1 CPA1 2406/4885SLC7A5 1920/4885SLC1A3 4215/4885
US-11618746-B2 Inhibitors of APOL1 and methods of using same APOL1, APOB, NPC1L1 CPA1 3481/4885SLC7A5 949/4885SLC1A3 3715/4885
US-20200377479-A1 INHIBITORS OF APOL1 AND METHODS OF USING SAME APOL1, SAAL1, LOXL1 CPA1 2336/4885SLC7A5 2713/4885SLC1A3 4699/4885

“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.