SCHEMBL989369

SCHEMBL989369

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

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
FABP5 Q01469 3/20 0.43
FABP7 O15540 2/20 0.43
TLR2 O60603 4/20 0.41
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
EPHX2 P34913 1/20 0.39
CYP1A2 P05177 1/20 0.38
TSHR P16473 1/20 0.38
MDM4 O15151 1/20 0.38
TP53 P04637 1/20 0.38
CASP3 P42574 1/20 0.38

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
SCHEMBL18528956 1.00 KMT2A (0.46) KMT2AFABP5FABP7TLR2CA1
SCHEMBL16011495 1.00 KMT2A (0.46) KMT2AFABP5FABP7TLR2CA1
SCHEMBL2316716 1.00 KMT2A (0.46) KMT2AFABP5FABP7TLR2CA1
SCHEMBL30704932 1.00 KMT2A (0.46) KMT2AFABP5FABP7TLR2CA1
SCHEMBL15878722 1.00 KMT2A (0.46) KMT2AFABP5FABP7TLR2CA1
SCHEMBL28975489 0.97 KMT2A (0.48) KMT2AFABP5FABP7TLR2CA1
SCHEMBL29090597 0.86 KMT2A (0.47) KMT2AFABP5FABP7TLR2CA1
SCHEMBL17339044 0.84 KMT2A (0.45) KMT2AFABP5FABP7TLR2CA1
SCHEMBL415413 0.84 KMT2A (0.45) KMT2AFABP5FABP7TLR2CA1
SCHEMBL29203732 0.84 KMT2A (0.45) KMT2AFABP5FABP7TLR2CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12599684-B2 Molecular probes and methods of use CASE WESTERN RESERVE UNIVERSITY (US) 2026-04-14 US disclosed
US-12023378-B2 Covalently linked antigen-antibody conjugates HOFFMANN-LA ROCHE INC. (US) 2024-07-02 US disclosed
US-20240156995-A1 MOLECULAR PROBES AND METHODS OF USE UNIV CASE WESTERN RESERVE (US) 2024-05-16 US disclosed
EP-3677285-B1 TARGETING PEPTIDES FOR DETECTING PROSTATE CANCER UNIV CASE WESTERN RESERVE (US) 2023-12-13 EP disclosed
US-11738099-B2 Molecular probes and methods of use CASE WESTERN RESERVE UNIVERSITY (US) 2023-08-29 US disclosed
US-11273223-B2 Bispecific anti-hapten/anti-blood brain barrier receptor antibodies, complexes thereof and their use as blood brain barrier shuttles HOFFMANN-LA ROCHE INC. (US) 2022-03-15 US disclosed
EP-3960768-A1 BISPECIFIC ANTI-HAPTEN/ANTI-BLOOD BRAIN BARRIER RECEPTOR ANTIBODIES, COMPLEXES THEREOF AND THEIR USE AS BLOOD BRAIN BARRIER SHUTTLES F. Hoffmann-La Roche AG (CH) 2022-03-02 EP disclosed
US-20210275695-A1 MOLECULAR PROBES AND METHODS OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-09-09 US disclosed
EP-3089996-B1 BISPECIFIC ANTI-HAPTEN/ANTI-BLOOD BRAIN BARRIER RECEPTOR ANTIBODIES, COMPLEXES THEREOF AND THEIR USE AS BLOOD BRAIN BARRIER SHUTTLES HOFFMANN LA ROCHE (CH) 2021-07-28 EP disclosed
US-20210069338-A1 BISPECIFIC ANTI-HAPTEN/ANTI-BLOOD BRAIN BARRIER RECEPTOR ANTIBODIES, COMPLEXES THEREOF AND THEIR USE AS BLOOD BRAIN BARRIER SHUTTLES HOFFMANN-LA ROCHE INC. 2021-03-11 US disclosed
WO-2010052144-A2 NEUROPEPTIDE-2-RECEPTOR (Y-2R) AGONISTS AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2010-05-14 WO disclosed
EP-2119455-A1 Tripartite raftophilic structures and their use Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2009-11-18 EP disclosed
EP-1732612-B1 TRIPARTITE CONJUGATES CONTAINING A STRUCTURE INTERACTING WITH CELL MEMBRANE RAFTS AND THEIR USE JADO TECHNOLOGIES GMBH (DE) 2009-09-16 EP disclosed
US-20080317767-A1 Tripartitle Raftophilic Strutures and their Use MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 2008-12-25 US disclosed
US-20070258899-A1 Diagnostic and therapeutic agents KARYON-CTT LTD (FI) 2007-11-08 US disclosed
WO-2007113385-A1 DIAGNOSTIC AND THERAPEUTIC AGENTS KARYON-CTT LTD (FI) 2007-10-11 WO disclosed
WO-2007113386-A1 PEPTIDE CONJUGATES KARYON-CTT LTD (FI) 2007-10-11 WO disclosed
US-20070231258-A1 Peptide conjugates KARYON CTT LTD. (FI) 2007-10-04 US disclosed
EP-1732612-A1 TRIPARTITE CONJUGATES CONTAINING A STRUCTURE INTERACTING WITH CELL MEMBRANE RAFTS AND THEIR USE Jadolabs Gmbh (DE) 2006-12-20 EP disclosed
WO-2005097199-A1 TRIPARTITE CONJUGATES CONTAINING A STRUCTURE INTERACTING WITH CELL MEMBRANE RAFTS AND THEIR USE JADOLABS GMBH (DE) 2005-10-20 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-20240156995-A1 MOLECULAR PROBES AND METHODS OF USE EDNRB, FGB, FN1 KMT2A 4637/4885FABP5 142/4885FABP7 84/4885
US-11738099-B2 Molecular probes and methods of use DDX21, FUS, DDIT3 KMT2A 2290/4885FABP5 699/4885FABP7 262/4885
US-20080317767-A1 Tripartitle Raftophilic Strutures and their Use FGB, CLTB, CD38 KMT2A 2719/4885FABP5 2394/4885FABP7 2036/4885
US-20210275695-A1 MOLECULAR PROBES AND METHODS OF USE EDNRB, FGB, FN1 KMT2A 4637/4885FABP5 142/4885FABP7 84/4885
US-20070258899-A1 Diagnostic and therapeutic agents YBX1, MLX, TPX2 KMT2A 3586/4885FABP5 2777/4885FABP7 3902/4885
US-20070231258-A1 Peptide conjugates PTMS, QPCT, CTH KMT2A 3390/4885FABP5 3207/4885FABP7 3579/4885
US-12599684-B2 Molecular probes and methods of use TFRC, FGB, SSTR3 KMT2A 3714/4885FABP5 741/4885FABP7 667/4885

“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.