SCHEMBL2040433

SCHEMBL2040433

NOC(C(=O)O)C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.50
FABP5 Q01469 3/20 0.49
FABP7 O15540 2/20 0.49
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
EPHX2 P34913 1/20 0.44
SRR Q9GZT4 3/20 0.44
MDM4 O15151 1/20 0.42
TP53 P04637 1/20 0.42
CASP3 P42574 2/20 0.42
CYP1A2 P05177 1/20 0.41
TSHR P16473 1/20 0.41
PSAT1 Q9Y617 1/20 0.40

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
SCHEMBL570371 0.83 KMT2A (0.49) KMT2AFABP5FABP7CA1CA2
SCHEMBL7121169 0.82 KMT2A (0.52) KMT2AFABP5FABP7CA1CA2
SCHEMBL27587697 0.82 KMT2A (0.52) KMT2AFABP5FABP7CA1CA2
SCHEMBL31222070 0.82 KMT2A (0.52) KMT2AFABP5FABP7CA1CA2
SCHEMBL26932742 0.81 KMT2A (0.51) KMT2AFABP5FABP7CA1CA2
SCHEMBL1162471 0.81 KMT2A (0.55) KMT2AFABP5FABP7CA1CA2
SCHEMBL29503798 0.80 FABP5 (0.52) KMT2AFABP5FABP7CA1CA2
SCHEMBL28459608 0.80 FABP5 (0.52) KMT2AFABP5FABP7CA1CA2
SCHEMBL29203790 0.79 KMT2A (0.45) KMT2AFABP5FABP7CA1CA2
SCHEMBL17339044 0.79 KMT2A (0.45) KMT2AFABP5FABP7CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116785450-A Maytansinoid derivatives with self-cleaving peptide linker and conjugates thereof 伊缪诺金公司 2023-09-22 CN disclosed
CN-116785451-A Maytansinoid derivatives with self-cleaving peptide linker and conjugates thereof 伊缪诺金公司 2023-09-22 CN disclosed
CN-110366431-B Maytansinoid derivatives with self-cleaving peptide linker and conjugates thereof 伊缪诺金公司 2023-07-18 CN disclosed
US-20230065814-A1 CONJUGATES OF-ELECTRON-PAIR-DONATING HETEROAROMATIC NITROGEN-COMPRISING COMPOUNDS ASCENDIS PHARMA A/S (DK) 2023-03-02 US disclosed
EP-3986477-A1 CONJUGATES OF pi-ELECTRON-PAIR-DONATING HETEROAROMATIC NITROGEN-COMPRISING COMPOUNDS Ascendis Pharma A/S (DK) 2022-04-27 EP disclosed
WO-2020254603-A1 CONJUGATES OF π-ELECTRON-PAIR-DONATING HETEROAROMATIC NITROGEN-COMPRISING COMPOUNDS ASCENDIS PHARMA A/S (DK) 2020-12-24 WO disclosed
US-9688663-B2 Crosslinking reagents, methods, and compositions for studying protein-protein interactions Cell Mosaic, Inc. (US) 2017-06-27 US disclosed
US-20160159777-A1 CROSSLINKING REAGENTS, METHODS, AND COMPOSITIONS FOR STUDYING PROTEIN-PROTEIN INTERACTIONS CELLMOSAIC INC (US) 2016-06-09 US disclosed
CN-102884077-B Conjugated FVIII variants 诺沃—诺迪斯克有限公司 2016-06-08 CN disclosed
US-20120322978-A1 CROSSLINKING REAGENTS, METHODS, AND COMPOSITIONS FOR STUDYING PROTEIN-PROTEIN INTERACTIONS CELLMOSAIC, LLC 2012-12-20 US disclosed
EP-2512523-A1 LABELLED INTEGRIN BINDERS GE Healthcare UK Limited (GB) 2012-10-24 EP disclosed
US-20120244074-A1 LABELLED INTEGRIN BINDERS GE HEALTHCARE LIMITED (GB) 2012-09-27 US disclosed
WO-2011109326-A2 CROSSLINKING REAGENTS, METHODS, AND COMPOSITIONS FOR STUDYING PROTEIN-PROTEIN INTERACTIONS HUANG YUMEI (US) 2011-09-09 WO disclosed
WO-2011073340-A1 LABELLED INTEGRIN BINDERS GE HEALTHCARE LIMITED (GB) 2011-06-23 WO disclosed
US-20100286024-A1 Insulinotropic compounds and uses thereof ACTIVOTEC SPP LIMITED (GB) 2010-11-11 US disclosed
EP-1943275-B1 INSULINOTROPIC COMPOUNDS AND USES THEREOF ACTIVOTEC SPP LTD (GB) 2010-06-16 EP disclosed
EP-1943275-A1 INSULINOTROPIC COMPOUNDS AND USES THEREOF Activotec SPP Limited (GB) 2008-07-16 EP disclosed
WO-2007051987-A1 INSULINOTROPIC COMPOUNDS AND USES THEREOF ACTIVOTEC SPP LIMITED (GB) 2007-05-10 WO disclosed
US-20030162185-A1 Products comprising a support to which nucleic acids are fixed and their use as dna chips CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2003-08-28 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 (6 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-20100286024-A1 Insulinotropic compounds and uses thereof GLP1R, GPR119, IAPP KMT2A 3871/4885FABP5 595/4885FABP7 946/4885
US-20030162185-A1 Products comprising a support to which nucleic acids are fixed and their use as dna chips DNMT3A, TARBP1, DNMT3L KMT2A 451/4885FABP5 560/4885FABP7 1425/4885
US-20120322978-A1 CROSSLINKING REAGENTS, METHODS, AND COMPOSITIONS FOR STUDYING PROTEIN-PROTEIN INTERACTIONS STUB1, PFN1, PFDN1 KMT2A 2126/4885FABP5 12/4885FABP7 53/4885
US-20120244074-A1 LABELLED INTEGRIN BINDERS ITGAV, ITGB6, ITGA2B KMT2A 2759/4885FABP5 513/4885FABP7 435/4885
US-20230065814-A1 CONJUGATES OF-ELECTRON-PAIR-DONATING HETEROAROMATIC NITROGEN-COMPRISING COMPOUNDS NQO1, NCL, ABCB1 KMT2A 2443/4885FABP5 3390/4885FABP7 3173/4885
US-20160159777-A1 CROSSLINKING REAGENTS, METHODS, AND COMPOSITIONS FOR STUDYING PROTEIN-PROTEIN INTERACTIONS PBDC1, RCSD1, STUB1 KMT2A 4097/4885FABP5 80/4885FABP7 241/4885

“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.