SCHEMBL30554382

SCHEMBL30554382

C[C@@H](NC(=O)OC(C)(C)C)c1cccc(Br)c1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.51
CTSK P43235 4/20 0.49
CTSS P25774 2/20 0.49
CTSB P07858 1/20 0.49
AAK1 Q2M2I8 7/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
POLB P06746 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
SCHEMBL3038444 1.00 ALDH1A1 (0.51) ALDH1A1CTSKCTSSCTSBAAK1
SCHEMBL12020767 1.00 ALDH1A1 (0.51) ALDH1A1CTSKCTSSCTSBAAK1
SCHEMBL5849869 1.00 ALDH1A1 (0.51) ALDH1A1CTSKCTSSCTSBAAK1
SCHEMBL9904174 1.00 ALDH1A1 (0.51) ALDH1A1CTSKCTSSCTSBAAK1
SCHEMBL30083281 0.94 ALDH1A1 (0.46) ALDH1A1CTSKCTSSCTSBAAK1
SCHEMBL6227427 0.85 ALDH1A1 (0.56) ALDH1A1L3MBTL1POLB
SCHEMBL30695643 0.85 CTSS (0.47) ALDH1A1CTSKCTSSCTSBAAK1
SCHEMBL19479409 0.84 CTSK (0.47) ALDH1A1CTSKCTSSPOLB
SCHEMBL6487442 0.84 CTSK (0.47) CTSKCTSS
SCHEMBL781623 0.84 CTSK (0.47) CTSKCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250025443-A1 COMPOUNDS AND METHODS FOR TREATING CORONA VIRUSES Clear Creek Bio, Inc. (US) 2025-01-23 US disclosed
CN-112020357-B Salt of indazolyl-containing tricyclic derivative and crystal form thereof 上海翰森生物医药科技有限公司 2023-08-29 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 (1 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-20250025443-A1 COMPOUNDS AND METHODS FOR TREATING CORONA VIRUSES ACE, PREP, PEPD ALDH1A1 2460/4885CTSK 93/4885CTSS 39/4885

“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.