SCHEMBL29818663

SCHEMBL29818663

CC(C)Cn1c(=O)n(C)c(=O)c2c(C(=O)N3CC[C@@H](O)C3)c(Cc3ccnc4ccccc34)sc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SLC16A1 P53985 20/20 1.00
▸ CYP2C9 P11712 13/20 1.00
▸ CYP3A4 P08684 8/20 1.00
▸ SLC16A7 O60669 1/20 0.98

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
Hydrochloric Acid SCHEMBL30148484 0.99 SLC16A1 (1.00) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL5864717 0.89 SLC16A1 (0.83) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL3827013 0.86 SLC16A1 (1.00) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL3826398 0.86 SLC16A1 (1.00) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL3826394 0.86 SLC16A1 (1.00) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL7677693 0.84 SLC16A1 (0.76) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL5864631 0.84 SLC16A1 (0.76) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL5864752 0.84 SLC16A1 (0.76) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL4847425 0.83 SLC16A1 (0.75) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL8144478 0.82 SLC16A1 (0.75) SLC16A1CYP2C9CYP3A4SLC16A7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025125766-A1 TREATMENT OR PREVENTION OF ISCHAEMIA REPERFUSION INJURY CAMBRIDGE ENTERPRISE LIMITED (GB) 2025-06-19 — — WO disclosed
US-20240252457-A1 Treatment or Prevention of Ischaemia Reperfusion Injury CAMBRIDGE ENTERPRISE LIMITED (GB) 2024-08-01 — — US disclosed
EP-4355315-A1 TREATMENT OR PREVENTION OF ISCHAEMIA REPERFUSION INJURY Cambridge Enterprise Limited (GB) 2024-04-24 — — EP disclosed
US-20240109925-A1 Enhanced Anti-Proliferative and Antitumor Immune Effects of Mitochondria-Targeted Hydroxyurea AIX-MARSEILLE UNIVERSITE (FR) 2024-04-04 — — US disclosed
EP-4284352-A1 ENHANCED ANTI-PROLIFERATIVE AND ANTITUMOR IMMUNE EFFECTS OF MITOCHONDRIA-TARGETED HYDROXYUREA The Medical College of Wisconsin, Inc. (US) 2023-12-06 — — EP disclosed
WO-2022263792-A1 TREATMENT OR PREVENTION OF ISCHAEMIA REPERFUSION INJURY CAMBRIDGE ENTERPRISE LIMITED (GB) 2022-12-22 — — WO disclosed
WO-2022164901-A1 ENHANCED ANTI-PROLIFERATIVE AND ANTITUMOR IMMUNE EFFECTS OF MITOCHONDRIA-TARGETED HYDROXYUREA THE MEDICAL COLLEGE OF WISCONSIN, INC. (US) 2022-08-04 — — 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 (2 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-20240252457-A1 Treatment or Prevention of Ischaemia Reperfusion Injury TNNI3, MPO, TXN SLC16A1 1893/4885CYP2C9 3561/4885CYP3A4 4349/4885
US-20240109925-A1 Enhanced Anti-Proliferative and Antitumor Immune Effects of Mitochondria-Targeted Hydroxyurea MAVS, TUFM, SHMT2 SLC16A1 668/4885CYP2C9 3411/4885CYP3A4 3117/4885

“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.

Send feedback