SCHEMBL1656554

SCHEMBL1656554

NC(=O)CCOCCCCOCCC(N)=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.42
CES2 O00748 2/20 0.33
KMT2A Q03164 4/20 0.32
TARDBP Q13148 1/20 0.32
CYP1A2 P05177 3/20 0.32
CYP3A4 P08684 3/20 0.32
CYP2C19 P33261 3/20 0.32
TP53 P04637 2/20 0.32
MEN1 O00255 2/20 0.32
TSHR P16473 1/20 0.32
FAAH O00519 1/20 0.32
SOAT1 P35610 1/20 0.32
ALOX15 P16050 2/20 0.32
BLM P54132 2/20 0.32
PMP22 Q01453 2/20 0.32
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GMNN O75496 1/20 0.32
USP2 O75604 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL31494110 0.94 GAA (0.38) GAAKMT2ATARDBPCYP1A2CYP3A4
SCHEMBL2449256 0.91 ALDH1A1 (0.37) GAAKMT2ACYP1A2CYP3A4CYP2C19
SCHEMBL22266241 0.91 TSHR (0.46) GAAKMT2AMEN1TSHRALDH1A1
SCHEMBL22266272 0.91 GAA (0.55) GAAKMT2AMEN1TSHRKDM4E
SCHEMBL6001519 0.89 GAA (0.36) GAA
SCHEMBL22297101 0.89 ALDH1A1 (0.48) GAACES2KMT2ACYP1A2CYP3A4
SCHEMBL20325130 0.89 GAA (0.58) GAACES2KMT2ACYP1A2CYP3A4
SCHEMBL8743883 0.89 CES2 (0.50) CES2KMT2ACYP1A2CYP3A4CYP2C19
SCHEMBL2576358 0.88 TP53 (0.35) GAAKMT2ACYP1A2CYP3A4CYP2C19
SCHEMBL22047274 0.88 TP53 (0.35) GAAKMT2ACYP1A2CYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024044636-A2 NANOCLUSTERS FUNCTIONALIZED WITH ADENOSINE TRIPHOSPHATE OR AN ANALOGUE AND THEIR USE THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2024-02-29 WO disclosed
WO-2023164224-A1 FUNCTIONALIZED NANOCLUSTERS AND THEIR USE IN TREATING BACTERIAL INFECTIONS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2023-08-31 WO disclosed
WO-2020219497-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF ANGIOGENESIS RELATED DISEASES THE UNIVERSITY OF MASSACHUSETTS (US) 2020-10-29 WO disclosed
EP-3386520-A1 METHODS OF TREATING AN OCULAR DISEASE OR DISORDER The Regents of The University of California (US) 2018-10-17 EP disclosed
WO-2017100470-A1 METHODS OF TREATING AN OCULAR DISEASE OR DISORDER THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-06-15 WO disclosed
WO-2011050342-A2 RATIONAL DESIGN OF A BIOCOMPATIBLE SYNTHETIC LAMININ-111 POLYMER AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-04-28 WO disclosed
US-20090105268-A1 Dihydropyrimidone Multimers and Their Use as Human Neutrophil, Elastase Inhibitors ARGENTA DISCOVERY LIMITED (GB) 2009-04-23 US disclosed
US-5336621-A Divalent hapten derivatives HOECHST CELANESE CORPORATION (US) 1994-08-09 US disclosed
EP-0183901-B1 BIFUNCTIONAL HAPTENS, METHOD FOR THEIR PRODUCTION AND THEIR USE BEHRINGWERKE Aktiengesellschaft (DE) 1992-07-08 EP disclosed
US-4760142-A Divalent hapten derivatives HOECHST CELANESE CORPORATION (US) 1988-07-26 US disclosed
EP-0183901-A2 Bifunctional haptens, method for their production and their use BEHRINGWERKE Aktiengesellschaft (DE) 1986-06-11 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 (1 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-20090105268-A1 Dihydropyrimidone Multimers and Their Use as Human Neutrophil, Elastase Inhibitors SERPINB1, ELANE, MPO GAA 504/4885CES2 1466/4885KMT2A 2796/4885

“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.