SCHEMBL25435839

SCHEMBL25435839

Cc1cn2nc(B3OC(C)(C)C(C)(C)O3)cc(C(F)(F)F)c2n1

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.31
▸ HSD17B10 Q99714 2/20 0.31
▸ F2RL3 Q96RI0 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ NTSR1 P30989 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL17260845 0.82 ALDH1A1 (0.34) HPGDHSD17B10ALDH1A1
SCHEMBL26814901 0.82 KDM4E (0.33) HPGDHSD17B10ALDH1A1
SCHEMBL27008050 0.81 ALDH1A1 (0.31) HPGDHSD17B10ALDH1A1
SCHEMBL27008083 0.78 ALDH1A1 (0.31) HPGDHSD17B10ALDH1A1
SCHEMBL25438598 0.78 ALDH1A1 (0.31) HPGDHSD17B10ALDH1A1
SCHEMBL27008199 0.77 SMPD3 (0.32) HPGDHSD17B10ALDH1A1
SCHEMBL27008088 0.77 GRM4 (0.31) —
SCHEMBL27008131 0.76 ALDH1A1 (0.30) HPGDHSD17B10ALDH1A1
SCHEMBL25202785 0.75 FFAR1 (0.34) HPGDHSD17B10
SCHEMBL25432447 0.75 HTT (0.38) HPGDHSD17B10F2RL3ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4698541-A1 THIENO[3,2-B]PYRIDINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2026-02-25 — — EP disclosed
US-20250179092-A1 PYRIDO[1,2-A]PYRIMIDIN-4-ONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2025-06-05 — — US disclosed
EP-4308576-B1 NEW THIAZOLOPYRIMIDINONE DERIVATIVES HOFFMANN LA ROCHE (CH) 2025-04-23 — — EP disclosed
EP-4490162-A1 PYRIDO[1,2-A]PYRIMIDIN-4-ONE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2025-01-15 — — EP disclosed
WO-2024218207-A1 THIENO[3,2-B]PYRIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2024-10-24 — — WO disclosed
EP-4308576-A1 NEW THIAZOLOPYRIMIDINONE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2024-01-24 — — EP disclosed
US-20240018163-A1 NEW THIAZOLOPYRIMIDINONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2024-01-18 — — US disclosed
US-20240018163-A1 NEW THIAZOLOPYRIMIDINONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2024-01-18 — — US disclosed
US-20240018163-A1 NEW THIAZOLOPYRIMIDINONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2024-01-18 — — US disclosed
WO-2023170115-A1 PYRIDO[1,2-A]PYRIMIDIN-4-ONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2023-09-14 — — WO disclosed
WO-2023170115-A1 PYRIDO[1,2-A]PYRIMIDIN-4-ONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2023-09-14 — — WO disclosed
WO-2022194801-A1 NEW THIAZOLOPYRIMIDINONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2022-09-22 — — 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-20240018163-A1 NEW THIAZOLOPYRIMIDINONE DERIVATIVES NDUFS3, FOXM1, MT-ND1 HPGD 2371/4885HSD17B10 933/4885F2RL3 1078/4885
US-20250179092-A1 PYRIDO[1,2-A]PYRIMIDIN-4-ONE DERIVATIVES ADORA1, P2RY1, CCNA1 HPGD 706/4885HSD17B10 3473/4885F2RL3 604/4885

“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.

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