SCHEMBL4572008

SCHEMBL4572008

CCCCCNC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.73
EPHX2 P34913 1/20 0.50
TLR2 O60603 4/20 0.48
MEN1 O00255 1/20 0.47

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
SCHEMBL7132449 0.99 KMT2A (0.75) KMT2AEPHX2TLR2
SCHEMBL8236471 0.96 KMT2A (0.70) KMT2AEPHX2
SCHEMBL793384 0.92 KMT2A (0.85) KMT2AEPHX2TLR2
SCHEMBL31419531 0.90 KMT2A (0.66) KMT2AEPHX2
SCHEMBL92796 0.90 KMT2A (0.66) KMT2AEPHX2
SCHEMBL697928 0.89 KMT2A (0.73) KMT2AEPHX2
Hydrochloric Acid SCHEMBL31419532 0.89 KMT2A (0.64) KMT2AEPHX2TLR2
SCHEMBL13124061 0.88 KMT2A (0.67) KMT2AEPHX2TLR2
SCHEMBL1660910 0.88 KMT2A (0.74) KMT2AEPHX2
SCHEMBL17971325 0.88 KMT2A (0.74) KMT2AEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3515880-B1 METHODS AND COMPOSITIONS FOR SYNTHESIS OF ENCODED LIBRARIES HITGEN INC (CN) 2023-05-10 EP disclosed
WO-2017210288-A1 ANTIBODY DRUG CONJUGATES HAVING DERIVATIVES OF AMATOXIN AS THE DRUG SORRENTO THERAPEUTICS, INC. (US) 2017-12-07 WO disclosed
EP-2452679-B1 TRIPRENYLPHENOLIC CYTOPROTECTIVE AGENT UNIV TOKYO NAT UNIV CORP (JP) 2014-05-28 EP disclosed
EP-2452679-A1 CYTOPROTECTIVE AGENT National University Corporation Tokyo University Of Agriculture and Technology (JP) 2012-05-16 EP disclosed
US-7897721-B2 Cyclic peptide compositions for treatment of sexual dysfunction PALATIN TECHNOLOGIES, INC. (US) 2011-03-01 US disclosed
US-7795378-B2 Peptide compositions for treatment of sexual dysfunction PALATIN TECHNOLOGIES, INC. (US) 2010-09-14 US disclosed
US-20100121027-A1 Cyclic Peptide Compositions for Treatment of Sexual Dysfunction PALATIN TECHNOLOGIES, INC. (US) 2010-05-13 US disclosed
US-20090253713-A1 Small Molecule Compositions for Sexual Dysfunction PALATIN TECHNOLOGIES, INC. (US) 2009-10-08 US disclosed
US-7550602-B1 Small molecule compositions for sexual dysfunction PALATIN TECHNOLOGIES, INC. (US) 2009-06-23 US disclosed
US-7473760-B2 Cyclic peptide compositions for treatment of sexual dysfunction PALATIN TECHNOLOGIES, INC. (US) 2009-01-06 US disclosed
US-7417027-B2 Linear and cyclic melanocortin receptor-specific peptides PALATIN TECHNOLOGIES, INC. (US) 2008-08-26 US disclosed
US-7396814-B2 Metallopeptide compositions for treatment of sexual dysfunction PALATIN TECHNOLOGIES, INC. (US) 2008-07-08 US disclosed
US-7176279-B2 Cyclic peptide compositions and methods for treatment of sexual dysfunction PALATIN TECHNOLOGIES, INC. (US) 2007-02-13 US disclosed
US-7176279-B2 Cyclic peptide compositions and methods for treatment of sexual dysfunction PALATIN TECHNOLOGIES, INC. (US) 2007-02-13 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 (2 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-20090253713-A1 Small Molecule Compositions for Sexual Dysfunction PDE3B, PDE3A, PDE5A KMT2A 3461/4885EPHX2 1817/4885TLR2 3878/4885
US-20100121027-A1 Cyclic Peptide Compositions for Treatment of Sexual Dysfunction VIP, GNRHR, NPR1 KMT2A 4341/4885EPHX2 4247/4885TLR2 4071/4885

“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.