SCHEMBL3152192

SCHEMBL3152192

CC(=O)Nc1cccc(C[C@H](N)C(=O)O)c1

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 3/20 0.73
NOS1 P29475 3/20 0.73
NOS2 P35228 3/20 0.73
SLC7A5 Q01650 5/20 0.59
ALPI P09923 1/20 0.57
PKM P14618 1/20 0.57
PTGS1 P23219 1/20 0.57
XIAP P98170 1/20 0.57
GRIA2 P42262 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
ALDH1A1 P00352 1/20 0.53
RAB9A P51151 2/20 0.50
POLB P06746 1/20 0.50
NR4A1 P22736 1/20 0.50
AOC3 Q16853 1/20 0.50

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
SCHEMBL20502934 1.00 NOS3 (0.73) NOS3NOS1NOS2SLC7A5ALPI
SCHEMBL20502933 1.00 NOS3 (0.73) NOS3NOS1NOS2SLC7A5ALPI
SCHEMBL6046229 0.89 NOS3 (0.71) NOS3NOS1NOS2SLC7A5ALPI
SCHEMBL3440766 0.88 NOS3 (0.57) NOS3NOS1NOS2NPSR1ALDH1A1
SCHEMBL22689784 0.87 NOS3 (0.64) NOS3NOS1NOS2SLC7A5ALPI
SCHEMBL22689782 0.87 NOS3 (0.64) NOS3NOS1NOS2SLC7A5ALPI
SCHEMBL29550135 0.87 NOS3 (0.64) NOS3NOS1NOS2SLC7A5ALPI
SCHEMBL6776043 0.86 NOS3 (0.67) NOS3NOS1NOS2SLC7A5ALPI
SCHEMBL2777855 0.86 NOS3 (0.67) NOS3NOS1NOS2SLC7A5ALPI
SCHEMBL2777853 0.86 NOS3 (0.67) NOS3NOS1NOS2SLC7A5ALPI

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
EP-1753719-B1 SUBSTITUTED PYRROLIDINE-2-ONES NOVARTIS AG (CH) 2010-03-03 EP claimed
US-20070172421-A1 Substituted pyrrolidine-2-ones NOVARTIS AG (CH) 2007-07-26 US claimed
CN-1960971-A Substituted pyrrolidine-2-ones NOVARTIS AG (CH) 2007-05-09 CN claimed
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
EP-1753719-B1 SUBSTITUTED PYRROLIDINE-2-ONES NOVARTIS AG (CH) 2010-03-03 EP disclosed
US-20070172421-A1 Substituted pyrrolidine-2-ones NOVARTIS AG (CH) 2007-07-26 US disclosed
CN-1960971-A Substituted pyrrolidine-2-ones NOVARTIS AG (CH) 2007-05-09 CN 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 (5 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 NOS3 4581/4885NOS1 4646/4885NOS2 4457/4885
US-20200040004-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF RICTOR, FKBP14, MTOR NOS3 4581/4885NOS1 4646/4885NOS2 4457/4885
US-20230000996-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF RICTOR, FKBP14, MTOR NOS3 4581/4885NOS1 4646/4885NOS2 4457/4885
US-20210094933-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF RICTOR, FKBP14, MTOR NOS3 4581/4885NOS1 4646/4885NOS2 4457/4885
US-20070172421-A1 Substituted pyrrolidine-2-ones PRLHR, EPOR, FLT1 NOS3 1187/4885NOS1 1052/4885NOS2 778/4885

“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.