SCHEMBL6518969

SCHEMBL6518969

CCOC(=O)NCc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
LMNA P02545 2/20 0.53
GAA P10253 2/20 0.53
APOBEC3A P31941 1/20 0.51
APOBEC3G Q9HC16 1/20 0.51
ALOX15 P16050 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
CYP2C19 P33261 3/20 0.49
CYP1A2 P05177 2/20 0.49
CA2 P00918 1/20 0.49
EPHX1 P07099 1/20 0.49
CYP2C9 P11712 1/20 0.49
KCNJ1 P48048 1/20 0.48
KCNH2 Q12809 1/20 0.48
KDM4E B2RXH2 1/20 0.48
CYP3A4 P08684 1/20 0.48

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
SCHEMBL7799200 0.86 MGLL (0.56) SMN1; SMN2LMNAGAAL3MBTL1CYP2C19
SCHEMBL14861111 0.86 GAA (0.58) TSHRGAAAPOBEC3AAPOBEC3GL3MBTL1
SCHEMBL9190987 0.85 KMT2A (0.63) SMN1; SMN2LMNAKCNJ1KCNH2KDM4E
SCHEMBL10599026 0.85 TSHR (0.70) TSHRSMN1; SMN2LMNAGAAALOX15
SCHEMBL4829258 0.82 MAPT (0.59) SMN1; SMN2LMNAGAAAPOBEC3AAPOBEC3G
SCHEMBL2045374 0.82 PPID (0.67) SMN1; SMN2LMNAGAAAPOBEC3AAPOBEC3G
SCHEMBL6966891 0.81 PLAU (0.59) SMN1; SMN2LMNACYP2C19CYP2C9
SCHEMBL26499969 0.81 MAOB (0.62) SMN1; SMN2LMNAGAAAPOBEC3AAPOBEC3G
SCHEMBL372131 0.81 PPARG (0.51) GAAAPOBEC3AAPOBEC3GL3MBTL1CYP2C19
SCHEMBL1521016 0.80 PTPRF (0.57) TSHRSMN1; SMN2GAAAPOBEC3AAPOBEC3G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4556480-A1 COMPOUNDS CONSTITUTING C20-MODIFIED SALINOMYCIN DERIVATIVES, A METHOD FOR OBTAINING THE SAME, A COMPOSITION CONTAINING THE SAME AND A USE OF SAID COMPOUNDS Fileclo Spolka Z Ograniczona Odpowiedzialnoscia (PL) 2025-05-21 EP disclosed
US-20240294541-A1 COMPOUNDS CONSTITUTING C20-MODIFIED SALINOMYCIN DERIVATIVES, A METHOD FOR OBTAINING THE SAME, A COMPOSITION CONTAINING THE SAME AND A USE OF SAID COMPOUNDS FILECLO SPOLKA Z OGRANICZONA ODPOWIEDZIALNOSCIA (PL) 2024-09-05 US disclosed
CN-113166102-A Anticancer compounds 法马马有限公司 2021-07-23 CN disclosed
US-20050123533-A1 Prodrugs activated by targeted catalytic proteins WELLSTAT BIOCATALYSIS, LLC 2005-06-09 US disclosed
US-20030096765-A1 Prodrugs activated by targeted catalytic proteins IGEN, INC. 2003-05-22 US disclosed
EP-0628542-B1 Process for the preparation of organic carbamates BAYER AG (DE) 1997-04-09 EP disclosed
EP-0746336-A1 PRODRUGS ACTIVATED BY TARGETED CATALYTIC PROTEINS IGEN, INC. (US) 1996-12-11 EP disclosed
EP-0746336-A4 PRODRUGS ACTIVATED BY TARGETED CATALYTIC PROTEINS IGEN INC (US) 1996-07-26 EP disclosed
EP-0628542-A1 Process for the preparation of organic carbonates BAYER AG (DE) 1994-12-14 EP disclosed
WO-1993002703-A1 PRODRUGS ACTIVATED BY TARGETED CATALYTIC PROTEINS IGEN, INC. (US) 1993-02-18 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-20050123533-A1 Prodrugs activated by targeted catalytic proteins DNPH1, DNPEP, PNP TSHR 4068/4885SMN1; SMN2 4221/4885LMNA 4566/4885
US-20030096765-A1 Prodrugs activated by targeted catalytic proteins DNPH1, DNPEP, PNP TSHR 4068/4885SMN1; SMN2 4221/4885LMNA 4566/4885
US-20240294541-A1 COMPOUNDS CONSTITUTING C20-MODIFIED SALINOMYCIN DERIVATIVES, A METHOD FOR OBTAINING THE SAME, A COMPOSITION CONTAINING THE SAME AND A USE OF SAID COMPOUNDS MRPS22, MRPS27, DHPS TSHR 4476/4885SMN1; SMN2 2788/4885LMNA 927/4885

“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.