SCHEMBL24740358

SCHEMBL24740358

NC(=O)[C@@H](N)CC1C(=O)Nc2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 10/20 1.00
TDO2 P48775 4/20 0.79
GSK3B P49841 2/20 0.50
EGFR P00533 2/20 0.46
SRC P12931 1/20 0.46
MAPT P10636 2/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
L3MBTL1 Q9Y468 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
Hydrochloric Acid SCHEMBL25245762 0.99 IDO1 (0.97) IDO1TDO2GSK3BEGFRSRC
SCHEMBL31265741 0.88 IDO1 (1.00) IDO1TDO2GSK3BEGFRSRC
SCHEMBL5286855 0.88 IDO1 (1.00) IDO1TDO2GSK3BEGFRSRC
SCHEMBL5528789 0.88 IDO1 (1.00) IDO1TDO2GSK3BEGFRSRC
SCHEMBL1226606 0.88 IDO1 (1.00) IDO1TDO2GSK3BEGFRSRC
SCHEMBL31550888 0.88 IDO1 (1.00) IDO1TDO2GSK3BEGFRSRC
Hydrochloric Acid SCHEMBL9818269 0.87 IDO1 (0.97) IDO1TDO2GSK3BEGFRSRC
SCHEMBL25762241 0.84 IDO1 (0.72) IDO1TDO2GSK3BEGFRSRC
SCHEMBL6507505 0.83 IDO1 (0.72) IDO1TDO2GSK3BEGFRMAPT
Hydrochloric Acid SCHEMBL25245765 0.81 IDO1 (0.67) IDO1TDO2GSK3BEGFRSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023245162-A2 COMPOUNDS FOR TREATMENT A CORONAVIRUS INFECTION TRAWSFYNYDD THERAPEUTICS, INC. (US) 2023-12-21 WO disclosed
CN-116685576-A Cysteine protease inhibitors and methods of use thereof 美商帕迪斯生物科学公司 2023-09-01 CN disclosed
US-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. 2023-07-06 US disclosed
US-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. 2023-07-06 US disclosed
US-11524940-B1 Inhibitors of cysteine proteases and methods of use thereof Pardes Biosciences, Inc. (US) 2022-12-13 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 (2 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-11524940-B1 Inhibitors of cysteine proteases and methods of use thereof CTRL, CTSV, CTSL IDO1 1633/4885TDO2 2237/4885GSK3B 1161/4885
US-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF CTRL, CTSL, CTSV IDO1 1859/4885TDO2 1845/4885GSK3B 1300/4885

“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.