SCHEMBL24028569

SCHEMBL24028569

CC(C)NC(=O)c1nc2cccc(Cl)c2[nH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
ALOX15 P16050 2/20 0.42
TSHR P16473 2/20 0.42
CASP1 P29466 1/20 0.42
TP53 P04637 1/20 0.40
CLK1 P49759 1/20 0.39
CDK9 P50750 1/20 0.39
CDK5 Q00535 1/20 0.39
DYRK1A Q13627 1/20 0.39
DYRK2 Q92630 1/20 0.39
CLK4 Q9HAZ1 1/20 0.39
DYRK1B Q9Y463 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
MYC P01106 1/20 0.38
SMYD3 Q9H7B4 1/20 0.37
ALPL P05186 1/20 0.37
LMNA P02545 1/20 0.37
NR4A2 P43354 1/20 0.36
PIM1 P11309 1/20 0.36

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
SCHEMBL29063123 0.84 CLK1 (0.41) ALOX15CLK1CDK9CDK5DYRK1A
SCHEMBL23836116 0.82 TSHR (0.46) POLBALOX15TSHRCASP1CDK9
SCHEMBL23835755 0.81 DYRK1A (0.41) CLK1CDK9CDK5DYRK1ADYRK2
SCHEMBL24113223 0.81 NR4A2 (0.48) POLBTSHRCASP1CLK1CDK9
SCHEMBL25768259 0.81 ABL1 (0.42) ALOX15CLK1CDK9CDK5DYRK1A
SCHEMBL25758835 0.80 ALOX15 (0.42) POLBALOX15TSHRCASP1TP53
SCHEMBL25758899 0.77 HPGDS (0.43) POLBALOX15TP53CDK9DYRK1A
SCHEMBL7706759 0.77 DYRK1A (0.51) TSHRCLK1CDK9CDK5DYRK1A
SCHEMBL30310472 0.77 DYRK1A (0.51) TSHRCLK1CDK9CDK5DYRK1A
SCHEMBL26178483 0.77 DYRK1A (0.38) CLK1CDK9CDK5DYRK1ADYRK2

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-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-20230192663-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. 2023-06-22 US disclosed
US-20220162194-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. 2022-05-26 US disclosed
US-11312704-B2 Inhibitors of cysteine proteases and methods of use thereof Pardes Biosciences, Inc. (US) 2022-04-26 US disclosed
US-20210355111-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. 2021-11-18 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 (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-11312704-B2 Inhibitors of cysteine proteases and methods of use thereof CTSV, CTRL, CTSL POLB 2086/4885ALOX15 1562/4885TSHR 4702/4885
US-20220162194-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF CTSV, CTRL, CTSL POLB 2086/4885ALOX15 1562/4885TSHR 4702/4885
US-20210355111-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF CTRL, CTSV, CTSL POLB 2487/4885ALOX15 1749/4885TSHR 4585/4885
US-20230192663-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF CTSV, CTRL, CTSL POLB 2086/4885ALOX15 1562/4885TSHR 4702/4885
US-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF CTRL, CTSL, CTSV POLB 2188/4885ALOX15 1455/4885TSHR 4669/4885

“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.