SCHEMBL21164376

SCHEMBL21164376

CC(C)(C)OC(=O)NCCC[C@H](N)C(=O)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.55
SYK P43405 1/20 0.54
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
GAA P10253 1/20 0.52
DPP8 Q6V1X1 2/20 0.52
DPP7 Q9UHL4 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
SLC1A3 P43003 1/20 0.50
SLC1A1 P43005 1/20 0.50
IDO1 P14902 1/20 0.50
POLB P06746 1/20 0.50
MAPK1 P28482 1/20 0.50
ANPEP P15144 1/20 0.50
HTT P42858 1/20 0.49
RECQL P46063 1/20 0.49
DPP4 P27487 1/20 0.48
DPP9 Q86TI2 1/20 0.48
LTA4H P09960 1/20 0.48
KLK7 P49862 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
Hydrochloric Acid SCHEMBL29401089 0.99 MAPT (0.54) MAPTSYKMEN1KMT2AGAA
SCHEMBL20168169 0.96 MAPT (0.59) MAPTSYKMEN1KMT2AGAA
SCHEMBL7979181 0.96 MAPT (0.59) MAPTSYKMEN1KMT2AGAA
SCHEMBL5490556 0.96 MAPT (0.59) MAPTSYKMEN1KMT2AGAA
Hydrochloric Acid SCHEMBL29401553 0.95 MAPT (0.58) MAPTSYKMEN1KMT2ADPP8
SCHEMBL28251423 0.93 MAPT (0.56) MAPTSYKMEN1KMT2ADPP8
SCHEMBL28198501 0.93 MAPT (0.56) MAPTSYKMEN1KMT2ADPP8
SCHEMBL17878734 0.93 SYK (0.56) MAPTSYKMEN1KMT2AGAA
SCHEMBL1021939 0.91 MAPT (0.52) MAPTSYKMEN1KMT2AGAA
SCHEMBL918814 0.91 MAPT (0.52) MAPTSYKMEN1KMT2AGAA

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-20230270889-A1 Fluorescently-Traceable Amino Acid Derivative And Preparation Methods And Use Thereof Capital Medical University (CN) 2023-08-31 US disclosed
US-10738085-B1 Antimicrobial analogues of Gramicidin S UNIVERSITY OF SOUTH FLORIDA (US) 2020-08-11 US disclosed
US-10730913-B1 Antimicrobial analogues of gramicidin S UNIVERSITY OF SOUTH FLORIDA (US) 2020-08-04 US disclosed
US-10351602-B1 Antimicrobial analogues of gramicidin S UNIVERSITY OF SOUTH FLORIDA (US) 2019-07-16 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 (4 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-10730913-B1 Antimicrobial analogues of gramicidin S GMPS, AAAS, GNPDA1 MAPT 4758/4885SYK 3102/4885MEN1 4579/4885
US-10351602-B1 Antimicrobial analogues of gramicidin S GMPS, AAAS, GNPDA1 MAPT 4758/4885SYK 3102/4885MEN1 4579/4885
US-10738085-B1 Antimicrobial analogues of Gramicidin S GMPS, AAAS, GNPDA1 MAPT 4758/4885SYK 3102/4885MEN1 4579/4885
US-20230270889-A1 Fluorescently-Traceable Amino Acid Derivative And Preparation Methods And Use Thereof SLC7A5, BCAT2, BCAT1 MAPT 3137/4885SYK 2157/4885MEN1 4025/4885

“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.