SCHEMBL927388

SCHEMBL927388

O=[N+]([O-])c1cccnc1S[S]

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.62
▸ KMT2A Q03164 3/20 0.62
▸ ALDH1A1 P00352 4/20 0.54
▸ GAA P10253 2/20 0.54
▸ PKM P14618 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ MAPT P10636 5/20 0.52
▸ PDE10A Q9Y233 1/20 0.51
▸ POLB P06746 2/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ MAPK1 P28482 1/20 0.48
▸ CYP1A2 P05177 2/20 0.46
▸ CYP2C9 P11712 2/20 0.46
▸ NCOA1 Q15788 1/20 0.46
▸ NCOA3 Q9Y6Q9 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ RAB9A P51151 2/20 0.45
▸ HTT P42858 1/20 0.43
▸ LMNA P02545 2/20 0.43
▸ PAX8 Q06710 1/20 0.43

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
SCHEMBL6849222 0.85 MEN1 (0.71) MEN1KMT2AALDH1A1GAAPKM
SCHEMBL29627490 0.85 MEN1 (0.61) MEN1KMT2AALDH1A1GAAPKM
SCHEMBL70297 0.85 MEN1 (0.61) MEN1KMT2AALDH1A1GAAPKM
SCHEMBL112949 0.81 MEN1 (0.58) MEN1KMT2AALDH1A1GAAPKM
SCHEMBL4988971 0.81 SMN1; SMN2 (0.61) MEN1KMT2AALDH1A1GAAPKM
SCHEMBL795882 0.81 MEN1 (0.62) MEN1KMT2AALDH1A1GAAPKM
SCHEMBL6967207 0.81 MEN1 (0.58) MEN1KMT2AALDH1A1GAAPKM
SCHEMBL1763611 0.81 MEN1 (0.58) MEN1KMT2AALDH1A1GAAPKM
SCHEMBL70296 0.81 MEN1 (0.58) MEN1KMT2AALDH1A1GAAPKM
SCHEMBL29938229 0.81 MEN1 (0.58) MEN1KMT2AALDH1A1GAAPKM

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 130 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200148764-A1 CROSS-LINKERS AND THEIR USES IMMUNOGEN, INC. 2020-05-14 — — US claimed
US-20180291100-A1 CROSS-LINKERS AND THEIR USES IMMUNOGEN SWITZERLAND GMBH (CH) 2018-10-11 — — US claimed
EP-2281006-B1 CROSS-LINKERS AND THEIR USES IMMUNOGEN INC (US) 2017-08-02 — — EP claimed
US-8236319-B2 Cross-linkers and their uses IMMUNOGEN, INC. (US) 2012-08-07 — — US claimed
EP-1601373-A4 INTRACELLULAR DELIVERY OF SMALL MOLECULES PROTEINS AND NUCLEIC ACIDS BIOWHITTAKER TECHNOLOGIES INC (US) 2007-07-11 — — EP claimed
US-7166692-B2 Intracellular delivery of small molecules, proteins, and nucleic acids CANBREX BIO SCIENCE WALKERSVILLE, INC. (US) 2007-01-23 — — US claimed
US-20060106197-A1 Intracellular delivery of small molecules, proteins, and nucleic acids LONZA BIOSCIENCE TECHNOLOGIES, INC. 2006-05-18 — — US claimed
EP-1601373-A2 INTRACELLULAR DELIVERY OF SMALL MOLECULES PROTEINS AND NUCLEIC ACIDS Biowhittaker Technologies, Inc. (US) 2005-12-07 — — EP claimed
US-20040209797-A1 Intracellular delivery of small molecules, proteins, and nucleic acids LONZA WALKERSVILLE INC. 2004-10-21 — — US claimed
WO-2004078933-A2 INTRACELLULAR DELIVERY OF SMALL MOLECULES PROTEINS AND NUCLEIC ACIDS BIOWHITTAKER TECHNOLOGIES INC. (US) 2004-09-16 — — WO claimed
EP-4242220-A1 PEPTIDE CROSSLINKING AGENT AND CROSSLINKED PEPTIDE WHICH IS CROSSLINKED USING SAID CROSSLINKING AGENT Kagoshima University (JP) 2023-09-13 — — EP disclosed
US-20210312797-A9 PROLACTIN RECEPTOR BINDING PROTEINS AND USES THEREOF ABBVIE INC (US) 2021-10-07 — — US disclosed
CN-107090034-B M-CSF specific monoclonal antibody and application thereof 诺华疫苗和诊断公司 2021-10-01 — — CN disclosed
EP-3851126-A1 MAYTANSINOID-CELL-BINDING AGENT CONJUGATES ImmunoGen, Inc. (US) 2021-07-21 — — EP disclosed
US-11046762-B2 Cross-linkers and their uses IMMUNOGEN, INC. (US) 2021-06-29 — — US disclosed
US-20040039176-A1 Cross-linkers with high reactivity and solubility and their use in the preparation of conjugates for targeted delivery of small molecule drugs IMMUNOGEN, INC. 2004-02-26 — — US disclosed
WO-2004016801-A2 CROSS-LINKERS WITH HIGH REACTIVITY AND SOLUBILITY AND THEIR USE IN THE PREPARATION OF CONJUGATES FOR TARGETED DELIVERY OF SMALL MOLECULE DRUGS IMMUNOGEN, INC. (US) 2004-02-26 — — WO disclosed
US-20030212011-A1 Macrolides with antibacterial activity BASILEA PHARMACEUTICA AG (CH) 2003-11-13 — — US disclosed
WO-2003072588-A1 MACROLIDES WITH ANTIBACTERIAL ACTIVITY BASILEA PHARMACEUTICA AG (CH) 2003-09-04 — — WO disclosed
US-4866180-A MITOMYCIN ANALOGS; ANTITUMOR AGENTS BRISTOL-MYERS COMPANY (US) 1989-09-12 — — 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 (5 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-20030212011-A1 Macrolides with antibacterial activity MRPL21, RPS21, MRPS18A MEN1 1793/4885KMT2A 3930/4885ALDH1A1 3345/4885
US-20180291100-A1 CROSS-LINKERS AND THEIR USES MTCL3, DCLRE1A, PCNA MEN1 3140/4885KMT2A 3217/4885ALDH1A1 3130/4885
US-20200148764-A1 CROSS-LINKERS AND THEIR USES MTCL3, DCLRE1A, PCNA MEN1 3140/4885KMT2A 3217/4885ALDH1A1 3130/4885
US-11046762-B2 Cross-linkers and their uses MTCL3, DCLRE1A, PCNA MEN1 3140/4885KMT2A 3217/4885ALDH1A1 3130/4885
US-20040039176-A1 Cross-linkers with high reactivity and solubility and their use in the preparation of conjugates for targeted delivery of small molecule drugs CD44, ABCG2, EPCAM MEN1 4531/4885KMT2A 3717/4885ALDH1A1 1402/4885

“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.

Send feedback