SCHEMBL5497609

SCHEMBL5497609

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

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.59
FABP5 Q01469 3/20 0.52
FABP7 O15540 2/20 0.52
EPHX2 P34913 1/20 0.47
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CASP3 P42574 2/20 0.44
LMNA P02545 1/20 0.42
TNF P01375 1/20 0.41
CYP1A2 P05177 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL31378081 1.00 KMT2A (0.59) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL5497604 0.93 KMT2A (0.55) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL1853371 0.91 KMT2A (0.64) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL2401694 0.89 KMT2A (0.70) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL5972005 0.89 KMT2A (0.70) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL30988970 0.88 KMT2A (0.54) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL7262938 0.87 KMT2A (0.50) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL30103837 0.87 KMT2A (0.53) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL3623157 0.87 KMT2A (0.55) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL31419530 0.86 KMT2A (0.49) KMT2AFABP5FABP7EPHX2CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12029736-B2 Camptothecin derivatives and conjugates thereof MEDIBOSTON LIMITED (HK) 2024-07-09 US disclosed
US-20240066135-A1 DRUG CONJUGATES AND USES THEREOF SUPERTRANS MEDICAL LTD (IL) 2024-02-29 US disclosed
US-20230310634-A1 ANTI-HUMAN VISTA ANTIBODIES AND USE THEREOF IMMUNEXT INC (US) 2023-10-05 US disclosed
US-11649220-B2 Probucol derivative, preparation method therefor and use thereof DEMOTECH.INC. (CN) 2023-05-16 US disclosed
US-20220204565-A1 Cyclic Peptide Antiviral Agents and Methods Using Same UNIV DREXEL (US) 2022-06-30 US disclosed
US-20220204565-A1 Cyclic Peptide Antiviral Agents and Methods Using Same UNIV DREXEL (US) 2022-06-30 US disclosed
US-20190375792-A1 Cyclic Peptide Antiviral Agents and Methods Using Same NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2019-12-12 US disclosed
US-20190375792-A1 Cyclic Peptide Antiviral Agents and Methods Using Same NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2019-12-12 US disclosed
US-20180119151-A1 SINGLE-STRANDED NUCLEIC ACID MOLECULE HAVING DELIVERY FUNCTION AND GENE EXPRESSION REGULATING ABILITY BONAC CORPORATION (JP) 2018-05-03 US disclosed
WO-2018053013-A1 CYCLIC PEPTIDE ANTIVIRAL AGENTS AND METHODS USING SAME DREXEL UNIVERSITY (US) 2018-03-22 WO disclosed
WO-2001029065-A1 PROCESS FOR PREPARING PEPTIDE INTERMEDIATES MERCK SHARP & DOHME LIMITED (GB) 2001-04-26 WO disclosed
US-6184389-B1 FEATURE A PLURALITY OF FUNCTIONAL GROUPS ATTACHED TO BACKBONE AND PHOSPHORAMIDATE SITES ISIS PHARMACEUTICALS, INC. 2001-02-06 US disclosed
EP-0865439-A4 COMBINATORIAL LIBRARIES HAVING AMINODIOL MONOMER SUBUNITS ISIS PHARMACEUTICALS INC (US) 1998-11-11 EP disclosed
EP-0865439-A1 COMBINATORIAL LIBRARIES HAVING AMINODIOL MONOMER SUBUNITS ISIS PHARMACEUTICALS, INC. (US) 1998-09-23 EP disclosed
US-5714606-A OLIGONUCLEOTIDE HAVING RECEPTOR BINDING SITES; ENZYME INHIBITORS, ANTIINFLAMMATORY AGENTS, MEDICAL DIAGNOSIS ISIS PHARMACEUTICALS, INC. (US) 1998-02-03 US disclosed
EP-0739335-A4 PYRROLIDINE-CONTAINING MONOMERS AND OLIGOMERS ISIS PHARMACEUTICALS INC (US) 1997-04-02 EP disclosed
WO-1996040672-A1 COMBINATORIAL LIBRARIES HAVING AMINODIOL MONOMER SUBUNITS ISIS PHARMACEUTICALS, INC. (US) 1996-12-19 WO disclosed
EP-0739335-A1 PYRROLIDINE-CONTAINING MONOMERS AND OLIGOMERS ISIS PHARMACEUTICALS, INC. (US) 1996-10-30 EP disclosed
US-5519134-A ANTIINFLAMMATORY AGENTS ISIS PHARMACEUTICALS, INC. (US) 1996-05-21 US disclosed
WO-1995018792-A1 PYRROLIDINE-CONTAINING MONOMERS AND OLIGOMERS ISIS PHARMACEUTICALS, INC. (US) 1995-07-13 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 (7 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-20180119151-A1 SINGLE-STRANDED NUCLEIC ACID MOLECULE HAVING DELIVERY FUNCTION AND GENE EXPRESSION REGULATING ABILITY ZFX, ZFR, SRRT KMT2A 1325/4885FABP5 1834/4885FABP7 1081/4885
US-20190375792-A1 Cyclic Peptide Antiviral Agents and Methods Using Same VIP, CCL5, ZC3HAV1 KMT2A 4728/4885FABP5 3247/4885FABP7 3769/4885
US-11649220-B2 Probucol derivative, preparation method therefor and use thereof PNLIP, FAR1, CETP KMT2A 4090/4885FABP5 259/4885FABP7 67/4885
US-20220204565-A1 Cyclic Peptide Antiviral Agents and Methods Using Same ZC3HAV1, VIP, LNPEP KMT2A 3656/4885FABP5 2507/4885FABP7 3564/4885
US-12029736-B2 Camptothecin derivatives and conjugates thereof TOP2A, TOP1, XPA KMT2A 2733/4885FABP5 4634/4885FABP7 4808/4885
US-20230310634-A1 ANTI-HUMAN VISTA ANTIBODIES AND USE THEREOF CD47, CLTA, FCGR2A KMT2A 1155/4885FABP5 362/4885FABP7 1244/4885
US-20240066135-A1 DRUG CONJUGATES AND USES THEREOF SLC7A1, ABCB11, SLC1A5 KMT2A 3532/4885FABP5 1135/4885FABP7 1607/4885

“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.