SCHEMBL16329206

SCHEMBL16329206

CC(=O)C(CCCCNC(=O)OC(C)(C)C)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.75

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.53
▸ TLR2 O60603 3/20 0.51
▸ TLR1 Q15399 1/20 0.51
▸ MDM2 Q00987 3/20 0.51
▸ MEN1 O00255 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ MDM4 O15151 1/20 0.44
▸ TP53 P04637 1/20 0.44

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
SCHEMBL15750412 1.00 KMT2A (0.53) KMT2ATLR2TLR1MDM2MEN1
SCHEMBL31522724 1.00 KMT2A (0.53) KMT2ATLR2TLR1MDM2MEN1
SCHEMBL12264511 0.93 KMT2A (0.52) KMT2ATLR2TLR1MDM2MEN1
SCHEMBL27261267 0.93 TLR2 (0.54) KMT2ATLR2TLR1MDM2MEN1
SCHEMBL30783495 0.93 TLR2 (0.54) KMT2ATLR2TLR1MDM2MEN1
SCHEMBL13339086 0.93 MDM2 (0.49) KMT2ATLR2TLR1MDM2MDM4
SCHEMBL12506772 0.92 TLR2 (0.53) KMT2ATLR2TLR1MDM2MEN1
SCHEMBL2292778 0.92 MDM2 (0.59) KMT2ATLR2TLR1MDM2ALDH1A1
SCHEMBL2736294 0.92 TLR2 (0.53) KMT2ATLR2TLR1MDM2MEN1
SCHEMBL1738182 0.92 MDM2 (0.59) KMT2ATLR2TLR1MDM2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230131121-A1 BRANCHED DISCRETE PEG CONSTRUCTS AUDAX PRIVATE DEBT LLC, AS AGENT 2023-04-27 — — US disclosed
US-20170313656-A1 Branched Discrete PEG Constructs QUANTA BIODESIGN, LTD. 2017-11-02 — — US disclosed
EP-2309989-B1 DRUG LOADED POLYMERIC NANOPARTICLES AND METHODS OF MAKING AND USING SAME BIND THERAPEUTICS INC (US) 2016-09-07 — — EP disclosed
US-20130052130-A1 Branched Discreet PEG Constructs UNIVERSITY OF WASHINGTON (US) 2013-02-28 — — 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 (3 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-20170313656-A1 Branched Discrete PEG Constructs BTD, IDUA, DNPEP KMT2A 3152/4885TLR2 983/4885TLR1 850/4885
US-20230131121-A1 BRANCHED DISCRETE PEG CONSTRUCTS BTD, IDUA, DNPEP KMT2A 3009/4885TLR2 961/4885TLR1 847/4885
US-20130052130-A1 Branched Discreet PEG Constructs BTD, DNPEP, IDUA KMT2A 2440/4885TLR2 1044/4885TLR1 681/4885

“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.

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