SCHEMBL9544995

SCHEMBL9544995

CC(C)(C)OC(=O)N1C[C@H](Oc2ccccc2)C[C@@H]1C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 14/20 0.51
USP30 Q70CQ3 1/20 0.48
UCHL1 P09936 1/20 0.46
HTRA1 Q92743 1/20 0.42
P2RX3 P56373 1/20 0.42

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
SCHEMBL192535 1.00 MCL1 (0.51) MCL1USP30UCHL1HTRA1P2RX3
SCHEMBL29015574 1.00 MCL1 (0.51) MCL1USP30UCHL1HTRA1P2RX3
SCHEMBL252870 1.00 MCL1 (0.51) MCL1USP30UCHL1HTRA1P2RX3
SCHEMBL6842708 1.00 MCL1 (0.51) MCL1USP30UCHL1HTRA1P2RX3
SCHEMBL192536 1.00 MCL1 (0.51) MCL1USP30UCHL1HTRA1P2RX3
SCHEMBL23452261 1.00 MCL1 (0.51) MCL1USP30UCHL1HTRA1P2RX3
SCHEMBL7462140 0.90 MCL1 (0.53) MCL1P2RX3
SCHEMBL27190373 0.90 MCL1 (0.53) MCL1P2RX3
SCHEMBL27190288 0.90 MCL1 (0.53) MCL1P2RX3
SCHEMBL7722150 0.90 MCL1 (0.50) MCL1UCHL1

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-20220380347-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. 2022-12-01 US disclosed
WO-2021212039-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. (US) 2021-10-21 WO disclosed
WO-2021212039-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. (US) 2021-10-21 WO disclosed
EP-3773555-A1 FACTOR XIIA INHIBITORS University of Leeds (GB) 2021-02-17 EP disclosed
WO-2019186164-A1 FACTOR XIIA INHIBITORS UNIVERSITY OF LEEDS (GB) 2019-10-03 WO disclosed
WO-1993020099-A2 CCK AND/OR GASTRIN RECEPTOR LIGANDS FERRING B.V. (NL) 1993-10-14 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 (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-20220380347-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF CTRL, CTSV, CTSL MCL1 520/4885USP30 269/4885UCHL1 37/4885

“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.