SCHEMBL21146296

SCHEMBL21146296

CC(C)(C)OC(=O)n1cc(C[C@@H](N)C(=O)O)c2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.60
MAPT P10636 2/20 0.59
ALDH1A1 P00352 1/20 0.59
RECQL P46063 1/20 0.59
EPHX1 P07099 1/20 0.57
ADAM17 P78536 1/20 0.52
PDE10A Q9Y233 1/20 0.47
HTR6 P50406 1/20 0.44
SCN9A Q15858 1/20 0.44
SLC7A5 Q01650 1/20 0.44
ACHE P22303 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
MPO P05164 1/20 0.42
TSHR P16473 1/20 0.42
BLM P54132 1/20 0.42
PMP22 Q01453 1/20 0.42
HIF1A Q16665 1/20 0.42

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
SCHEMBL18528126 1.00 L3MBTL1 (0.60) L3MBTL1MAPTALDH1A1RECQLEPHX1
SCHEMBL18920985 1.00 L3MBTL1 (0.60) L3MBTL1MAPTALDH1A1RECQLEPHX1
SCHEMBL29400976 1.00 L3MBTL1 (0.60) L3MBTL1MAPTALDH1A1RECQLEPHX1
SCHEMBL487202 0.91 L3MBTL1 (0.63) L3MBTL1MAPTALDH1A1RECQLEPHX1
SCHEMBL17658726 0.91 L3MBTL1 (0.60) L3MBTL1MAPTALDH1A1RECQLEPHX1
SCHEMBL30912341 0.91 EPHX1 (0.62) L3MBTL1MAPTALDH1A1RECQLEPHX1
SCHEMBL29918287 0.91 L3MBTL1 (0.63) L3MBTL1MAPTALDH1A1RECQLEPHX1
SCHEMBL487203 0.91 L3MBTL1 (0.63) L3MBTL1MAPTALDH1A1RECQLEPHX1
SCHEMBL17656911 0.89 L3MBTL1 (0.58) L3MBTL1MAPTALDH1A1RECQLEPHX1
Hydrochloric Acid SCHEMBL29918249 0.89 L3MBTL1 (0.61) L3MBTL1MAPTALDH1A1RECQLEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230000996-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF THE JOHNS HOPKINS UNIVERSITY 2023-01-05 US disclosed
US-11066416-B2 Rapafucin derivative compounds and methods of use thereof THE JOHNS HOPKINS UNIVERSITY (US) 2021-07-20 US disclosed
WO-2021067439-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF THE JOHNS HOPKINS UNIVERSITY (US) 2021-04-08 WO disclosed
US-20210094933-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF THE JOHNS HOPKINS UNIVERSITY 2021-04-01 US disclosed
US-20200040004-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF RAPAFUSYN PHARMACEUTICALS, INC. 2020-02-06 US disclosed
WO-2019115614-A1 PEPTIDIC MELANOCORTIN 1 RECEPTOR AGONIST - SACCHARIDE FUNCTIONALISED CARBABORANE CONJUGATES UNIVERSITÄT LEIPZIG (DE) 2019-06-20 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 (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-11066416-B2 Rapafucin derivative compounds and methods of use thereof RICTOR, FKBP14, MTOR L3MBTL1 3251/4885MAPT 3230/4885ALDH1A1 4678/4885
US-20200040004-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF RICTOR, FKBP14, MTOR L3MBTL1 3251/4885MAPT 3230/4885ALDH1A1 4678/4885
US-20230000996-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF RICTOR, FKBP14, MTOR L3MBTL1 3251/4885MAPT 3230/4885ALDH1A1 4678/4885
US-20210094933-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF RICTOR, FKBP14, MTOR L3MBTL1 3251/4885MAPT 3230/4885ALDH1A1 4678/4885

“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.