SCHEMBL24344744

SCHEMBL24344744

CC(C)C(NC(=O)OCCOCCN1C(=O)CCC1=O)C(=O)NCC(=O)Nc1ccc(COC(=O)C(C)(C)C)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 2/20 0.36
▸ CA5A P35218 1/20 0.36
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ LMNA P02545 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ HPGD P15428 1/20 0.34
▸ CTSB P07858 2/20 0.34
▸ CTSK P43235 2/20 0.34
▸ CTSL P07711 2/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CASP1 P29466 1/20 0.33
▸ CASP3 P42574 1/20 0.33
▸ CASP7 P55210 1/20 0.33
▸ CASP9 P55211 1/20 0.33
▸ CASP6 P55212 1/20 0.33
▸ CASP8 Q14790 1/20 0.33
▸ CTSS P25774 2/20 0.33
▸ ALOX12 P18054 1/20 0.32
▸ CTSD P07339 1/20 0.32

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
SCHEMBL24343403 0.88 CA2 (0.33) CA2CA5AMEN1KMT2ALMNA
SCHEMBL21841758 0.83 ELANE (0.32) CA2CA5AMEN1KMT2ALMNA
SCHEMBL25150588 0.83 HTR2A (0.43) CA2CA5AALDH1A1CTSLELANE
SCHEMBL22239388 0.79 CA2 (0.35) CA2CA5AMEN1KMT2ALMNA
SCHEMBL23690592 0.79 MEN1 (0.36) CA2CA5AMEN1KMT2ALMNA
SCHEMBL23690546 0.78 KMT2A (0.40) CA2CA5AMEN1KMT2ALMNA
SCHEMBL23691030 0.78 MEN1 (0.39) CA2CA5AMEN1KMT2ALMNA
SCHEMBL26320033 0.78 MEN1 (0.38) CA2CA5AMEN1KMT2ALMNA
SCHEMBL21841738 0.78 ELANE (0.37) ELANE
SCHEMBL23229997 0.77 OPRK1 (0.36) CA2CA5ACA1ELANE

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-20230144211-A1 ANTIFOLATE LINKER-DRUGS AND ANTIBODY-DRUG CONJUGATES BYONDIS B.V. (NL) 2023-05-11 — — US disclosed
US-20220119392-A1 ANTIFOLATE LINKER-DRUGS AND ANTIBODY-DRUG CONJUGATES BYONDIS B.V. (NL) 2022-04-21 — — 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 (2 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-20230144211-A1 ANTIFOLATE LINKER-DRUGS AND ANTIBODY-DRUG CONJUGATES DHFR, FOLR1, MTHFD2 CA2 4161/4885CA5A 2321/4885MEN1 1545/4885
US-20220119392-A1 ANTIFOLATE LINKER-DRUGS AND ANTIBODY-DRUG CONJUGATES DHFR, FOLR1, MTHFD2 CA2 4161/4885CA5A 2321/4885MEN1 1545/4885

“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.

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