SCHEMBL23330740

SCHEMBL23330740

COC(=O)CCC(=O)c1ccc(-c2cccc3sccc23)s1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 2/20 0.38
DYRK1A Q13627 8/20 0.38
DYRK1B Q9Y463 8/20 0.38
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
POLQ O75417 1/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.36
PRP4K Q13523 1/20 0.36
RAB9A P51151 1/20 0.36
ERCC5 P28715 1/20 0.36
FEN1 P39748 1/20 0.36
HSD17B1 P14061 1/20 0.36
HSD11B1 P28845 1/20 0.36
HSD17B2 P37059 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
SCHEMBL29831644 1.00 STING1 (0.38) STING1DYRK1ADYRK1BALDH1A1HPGD
SCHEMBL23300749 0.92 ERCC5 (0.39) DYRK1ADYRK1BALDH1A1HPGDPOLQ
SCHEMBL29831759 0.86 DYRK1A (0.39) STING1DYRK1ADYRK1BALDH1A1HPGD
SCHEMBL23330764 0.86 DYRK1A (0.39) STING1DYRK1ADYRK1BALDH1A1HPGD
SCHEMBL23300792 0.86 STING1 (0.40) STING1ALDH1A1HPGDGAAMAPT
SCHEMBL23331125 0.83 ERCC5 (0.45) DYRK1ADYRK1BALDH1A1HPGDPRP4K
SCHEMBL29832289 0.80 POLQ (0.37) ALDH1A1MAPTPOLQLMNAPOLB
SCHEMBL23330457 0.80 POLQ (0.37) ALDH1A1MAPTPOLQLMNAPOLB
SCHEMBL23330404 0.76 ERCC5 (0.40) DYRK1ADYRK1BALDH1A1HPGDGAA
SCHEMBL23330544 0.71 POLQ (0.37) ALDH1A1MAPTPOLQPOLBHSD17B1

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
CN-112724127-B Five-membered heterocyclic oxocarboxylic acid compound and medical application thereof 中国科学院上海药物研究所 2023-02-17 CN disclosed
US-20230032101-A1 FIVE-MEMBERED HETEROCYCLIC OXOCARBOXYLIC ACID COMPOUND AND MEDICAL USE THEREOF SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2023-02-02 US disclosed
EP-4053124-A1 FIVE-MEMBERED HETEROCYCLIC OXOCARBOXYLIC ACID COMPOUND AND MEDICAL USE THEREOF Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) 2022-09-07 EP disclosed
CN-114829357-A Five-membered heterocyclic oxocarboxylic acid compound and medical application thereof 中国科学院上海药物研究所 2022-07-29 CN disclosed
WO-2021083060-A1 FIVE-MEMBERED HETEROCYCLIC OXOCARBOXYLIC ACID COMPOUND AND MEDICAL USE THEREOF 中国科学院上海药物研究所 2021-05-06 WO disclosed
CN-112724127-A Five-membered heterocyclic oxocarboxylic acid compound and medical application thereof 中国科学院上海药物研究所 2021-04-30 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-20230032101-A1 FIVE-MEMBERED HETEROCYCLIC OXOCARBOXYLIC ACID COMPOUND AND MEDICAL USE THEREOF STING1, CGAS, IRF3 STING1 1/4885DYRK1A 3914/4885DYRK1B 4177/4885

“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.