SCHEMBL23415531

SCHEMBL23415531

O=C(N[C@@H]1CCN(C(=O)O)C[C@@H]1C(=O)O)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CPB1 P15086 2/20 0.54
ALDH1A1 P00352 1/20 0.52
GAA P10253 1/20 0.52
CTSK P43235 2/20 0.51
CTSL P07711 1/20 0.51
CTSB P07858 1/20 0.51
DPP4 P27487 4/20 0.51
DPP7 Q9UHL4 4/20 0.51
KCNH2 Q12809 3/20 0.51
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HSD11B1 P28845 1/20 0.49
TSHR P16473 1/20 0.47
CASP3 P42574 3/20 0.45

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
SCHEMBL23415370 1.00 CPB1 (0.54) CPB1ALDH1A1GAACTSKCTSL
SCHEMBL28634160 0.89 ALDH1A1 (0.52) CPB1ALDH1A1GAACTSKCTSL
SCHEMBL28833984 0.88 CPB1 (0.54) CPB1ALDH1A1GAACTSKCTSL
SCHEMBL28833767 0.88 CPB1 (0.54) CPB1ALDH1A1GAACTSKCTSL
SCHEMBL21522663 0.87 CTSK (0.60) CPB1ALDH1A1GAACTSKCTSL
SCHEMBL29268593 0.87 CTSK (0.60) CPB1ALDH1A1GAACTSKCTSL
SCHEMBL29268591 0.87 CTSK (0.60) CPB1ALDH1A1GAACTSKCTSL
SCHEMBL6342264 0.86 CPB1 (0.50) CPB1ALDH1A1GAACTSKDPP4
SCHEMBL6713945 0.86 CPB1 (0.53) CPB1ALDH1A1GAACTSKCTSL
SCHEMBL19814180 0.86 CPB1 (0.50) CPB1ALDH1A1GAACTSKDPP4

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-20230100838-A1 COVALENT RAS INHIBITORS AND USES THEREOF WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2023-03-30 US disclosed
CN-114980976-A Covalent RAS inhibitors and uses thereof 锐新医药公司 2022-08-30 CN disclosed
WO-2021108683-A1 COVALENT RAS INHIBITORS AND USES THEREOF Revolution Medicines, Inc. (US) 2021-06-03 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 (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-20230100838-A1 COVALENT RAS INHIBITORS AND USES THEREOF KRAS, NRAS, HRAS CPB1 2027/4885ALDH1A1 3445/4885GAA 1277/4885

“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.