SCHEMBL4357945

SCHEMBL4357945

C=CS(=O)(=O)CCOCCOCCS(=O)(=O)C=C

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
TP53 P04637 2/20 0.36
TSHR P16473 2/20 0.36
HIF1A Q16665 2/20 0.36
HSD17B10 Q99714 1/20 0.36
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL259146 0.97 ALDH1A1 (0.32) ALDH1A1TP53TSHRHIF1AHSD17B10
SCHEMBL8557919 0.90
SCHEMBL16572452 0.89 ALDH1A1 (0.34) ALDH1A1TP53TSHRHIF1AHSD17B10
SCHEMBL12703069 0.89 MEN1 (0.46) ALDH1A1TP53TSHRHIF1AHSD17B10
SCHEMBL9237706 0.89 CA2 (0.40) ALDH1A1TP53TSHRHIF1AHSD17B10
Ethylene Glycol SCHEMBL27885940 0.88 TSHR (0.33) ALDH1A1TP53TSHRHIF1AHSD17B10
SCHEMBL749982 0.86 CA1 (0.33) ALDH1A1TP53HSD17B10CA2
SCHEMBL17453659 0.86 TSHR (0.43) ALDH1A1TP53TSHRHIF1AHSD17B10
SCHEMBL8780035 0.86 CA2 (0.30) CA2CA9
SCHEMBL8948892 0.86

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3753578-A1 CYTOTOXIC PEPTIDES AND CONJUGATES THEREOF Novartis AG (CH) 2020-12-23 EP disclosed
US-10787480-B2 Cytotoxic peptides and conjugates thereof NOVARTIS AG (CH) 2020-09-29 US disclosed
US-10699916-B2 Mold release film, process for its production, and process for producing semiconductor package AGC Inc. (JP) 2020-06-30 US disclosed
EP-3082877-B1 CYTOTOXIC PEPTIDES AND CONJUGATES THEREOF NOVARTIS AG (CH) 2019-08-28 EP disclosed
US-10392421-B2 Cytotoxic peptides and conjugates thereof NOVARTIS AG (CH) 2019-08-27 US disclosed
US-20190194315-A1 ANTIBODY DRUG CONJUGATES NOVARTIS AG (CH) 2019-06-27 US disclosed
US-20180244717-A1 CYTOTOXIC PEPTIDES AND CONJUGATES THEREOF NOVARTIS AG (CH) 2018-08-30 US disclosed
US-10039807-B2 bFGF-polymer conjugates, methods for making the same and applications thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-08-07 US disclosed
US-9988420-B2 Cytotoxic peptides and conjugates thereof NOVARTIS AG (CH) 2018-06-05 US disclosed
EP-3310813-A1 ANTIBODY DRUG CONJUGATES Novartis AG (CH) 2018-04-25 EP disclosed
US-20170207105-A1 MOLD RELEASE FILM, PROCESS FOR ITS PRODUCTION, AND PROCESS FOR PRODUCING SEMICONDUCTOR PACKAGE ASAHI GLASS COMPANY, LIMITED (JP) 2017-07-20 US disclosed
US-20170143795-A1 bFGF-POLYMER CONJUGATES, METHODS FOR MAKING THE SAME AND APPLICATIONS THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2017-05-25 US disclosed
WO-2016203432-A1 ANTIBODY DRUG CONJUGATES NOVARTIS AG (CH) 2016-12-22 WO disclosed
US-20160311853-A1 CYTOTOXIC PEPTIDES AND CONJUGATES THEREOF NOVARTIS AG (CH) 2016-10-27 US disclosed
US-20160311853-A1 CYTOTOXIC PEPTIDES AND CONJUGATES THEREOF NOVARTIS AG (CH) 2016-10-27 US disclosed
US-20160311853-A1 CYTOTOXIC PEPTIDES AND CONJUGATES THEREOF NOVARTIS AG (CH) 2016-10-27 US disclosed
EP-3082877-A2 CYTOTOXIC PEPTIDES AND CONJUGATES THEREOF Novartis AG (CH) 2016-10-26 EP disclosed
WO-2015095301-A2 CYTOTOXIC PEPTIDES AND CONJUGATES THEREOF IRM LLC (BM) 2015-06-25 WO disclosed
US-20140335045-A1 bFGF-POLYMER CONJUGATES, METHODS FOR MAKING THE SAME AND APPLICATIONS THEREOF NATIONAL SCIENCE FOUNDATION 2014-11-13 US disclosed
EP-2138481-A1 NONAQUEOUS ELECTROLYTE SOLUTION FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY USING THE SAME Ube Industries, Ltd. (JP) 2009-12-30 EP 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 (8 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-10787480-B2 Cytotoxic peptides and conjugates thereof CD47, NGLY1, VIP ALDH1A1 3311/4885TP53 14/4885TSHR 2353/4885
US-20190194315-A1 ANTIBODY DRUG CONJUGATES EPCAM, CDH1, VIM ALDH1A1 1376/4885TP53 101/4885TSHR 4722/4885
US-10392421-B2 Cytotoxic peptides and conjugates thereof CD47, NGLY1, VIP ALDH1A1 3311/4885TP53 14/4885TSHR 2353/4885
US-10039807-B2 bFGF-polymer conjugates, methods for making the same and applications thereof FGF2, FGF1, FGFR1 ALDH1A1 1396/4885TP53 861/4885TSHR 872/4885
US-20140335045-A1 bFGF-POLYMER CONJUGATES, METHODS FOR MAKING THE SAME AND APPLICATIONS THEREOF FGF2, FGF1, FGFR1 ALDH1A1 1396/4885TP53 861/4885TSHR 872/4885
US-20180244717-A1 CYTOTOXIC PEPTIDES AND CONJUGATES THEREOF CD47, NGLY1, VIP ALDH1A1 3311/4885TP53 14/4885TSHR 2353/4885
US-20160311853-A1 CYTOTOXIC PEPTIDES AND CONJUGATES THEREOF CD47, NGLY1, VIP ALDH1A1 3311/4885TP53 14/4885TSHR 2353/4885
US-20170143795-A1 bFGF-POLYMER CONJUGATES, METHODS FOR MAKING THE SAME AND APPLICATIONS THEREOF FGF2, FGF1, FGFR1 ALDH1A1 1396/4885TP53 861/4885TSHR 872/4885

“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.