SCHEMBL29526164

SCHEMBL29526164

CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1cnccc1C=O

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSS P25774 1/20 0.49
CTSK P43235 1/20 0.49
KDM4E B2RXH2 3/20 0.49
HTT P42858 1/20 0.49
CA2 P00918 2/20 0.46
ALDH1A1 P00352 3/20 0.45
HPGD P15428 2/20 0.45
AAK1 Q2M2I8 1/20 0.44
EGFR P00533 1/20 0.44
BACE1 P56817 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
SUV39H2 Q9H5I1 2/20 0.41
PSENEN Q9NZ42 1/20 0.39
REN P00797 2/20 0.38
CTSD P07339 1/20 0.38
CTSE P14091 1/20 0.38

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
SCHEMBL30492012 1.00 CTSS (0.49) CTSSCTSKKDM4EHTTCA2
SCHEMBL24420344 0.85 CTSS (0.53) CTSSCTSKKDM4EHTTCA2
SCHEMBL29526580 0.85 CTSS (0.53) CTSSCTSKKDM4EHTTCA2
SCHEMBL29526276 0.80 CTSS (0.50) CTSSCTSKKDM4EHTTCA2
SCHEMBL24420098 0.80 CTSS (0.50) CTSSCTSKKDM4EHTTCA2
SCHEMBL1020140 0.80 CYP17A1 (0.47)
SCHEMBL29957148 0.80 CYP17A1 (0.47)
SCHEMBL9128016 0.75 TP53 (0.62) CTSSCTSKKDM4EHTTCA2
SCHEMBL9128031 0.75 TP53 (0.62) CTSSCTSKKDM4EHTTCA2
SCHEMBL9744622 0.74 CTSS (0.55) CTSSCTSKKDM4EHTTCA2

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-12441691-B2 Bicyclic 1,4-diazepanones and therapeutic uses thereof CYTOKINETICS, INC. (US) 2025-10-14 US disclosed
US-20240368091-A1 BICYCLIC 1,4-DIAZEPANONES AND THERAPEUTIC USES THEREOF CYTOKINETICS, INC. 2024-11-07 US disclosed
US-11981644-B2 Bicyclic 1,4-diazepanones and therapeutic uses thereof CYTOKINETICS, INC. (US) 2024-05-14 US disclosed
EP-4240724-A1 BICYCLIC 1,4-DIAZEPANONES AND THERAPEUTIC USES THEREOF Cytokinetics, Inc. (US) 2023-09-13 EP disclosed
US-20230083960-A1 BICYCLIC 1,4-DIAZEPANONES AND THERAPEUTIC USES THEREOF CYTOKINETICS, INC. 2023-03-16 US disclosed
WO-2022099011-A1 BICYCLIC 1,4-DIAZEPANONES AND THERAPEUTIC USES THEREOF CYTOKINETICS, INC. (US) 2022-05-12 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-20240368091-A1 BICYCLIC 1,4-DIAZEPANONES AND THERAPEUTIC USES THEREOF MYLK2, MUSK, MYLK CTSS 4059/4885CTSK 2205/4885KDM4E 1838/4885
US-12441691-B2 Bicyclic 1,4-diazepanones and therapeutic uses thereof MYLK2, MUSK, MYLK CTSS 4059/4885CTSK 2205/4885KDM4E 1838/4885
US-11981644-B2 Bicyclic 1,4-diazepanones and therapeutic uses thereof MYLK2, MUSK, MYLK CTSS 4068/4885CTSK 2214/4885KDM4E 1842/4885
US-20230083960-A1 BICYCLIC 1,4-DIAZEPANONES AND THERAPEUTIC USES THEREOF MYLK2, MUSK, MYLK CTSS 4059/4885CTSK 2205/4885KDM4E 1838/4885

“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.