SCHEMBL25432447

SCHEMBL25432447

Cc1cn2nc(Cl)cc(C(F)(F)F)c2n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.38
▸ HPGD P15428 3/20 0.36
▸ HSD17B10 Q99714 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ LRRK2 Q5S007 1/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ PKM P14618 1/20 0.35
▸ KMT2A Q03164 3/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ STAT3 P40763 1/20 0.34
▸ STAT1 P42224 1/20 0.34
▸ CASP3 P42574 1/20 0.34
▸ SENP8 Q96LD8 1/20 0.34
▸ SENP7 Q9BQF6 1/20 0.34
▸ SENP6 Q9GZR1 1/20 0.34
▸ PIK3R1 P27986 1/20 0.34
▸ PIK3CA P42336 1/20 0.34
▸ AR P10275 2/20 0.33

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
SCHEMBL31118776 0.78 L3MBTL1 (0.40) HTTALDH1A1
SCHEMBL477053 0.78 ALDH1A1 (0.41) HTTHPGDHSD17B10ALDH1A1NPC1
SCHEMBL1826272 0.78 ALDH1A1 (0.41) HTTHPGDHSD17B10ALDH1A1NPC1
SCHEMBL25433721 0.77 HPGD (0.34) HTTHPGDHSD17B10ALDH1A1SMN1; SMN2
Bromide SCHEMBL25241165 0.76 ALDH1A1 (0.40) HTTHPGDHSD17B10ALDH1A1NPC1
Hydrochloric Acid SCHEMBL21979887 0.76 ALDH1A1 (0.40) HTTHPGDHSD17B10ALDH1A1NPC1
SCHEMBL26978235 0.76 ASPH (0.41) HSD17B10ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL23813584 0.75 ALDH1A1 (0.37) HPGDHSD17B10ALDH1A1KMT2AMEN1
SCHEMBL25435839 0.75 HPGD (0.31) HTTHPGDHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL1826708 0.75 ALDH1A1 (0.39) HTTHPGDHSD17B10ALDH1A1NPC1

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 20 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-4308572-B1 NEW THIENOPYRIMIDINONE DERIVATIVES HOFFMANN LA ROCHE (CH) 2025-04-23 — — EP 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
EP-4308577-B1 NEW THIADIAZOLOPYRIMIDONE DERIVATIVES HOFFMANN LA ROCHE (CH) 2024-12-25 — — EP disclosed
CN-118843634-A Pyrido [1,2-a ] pyrimidin-4-one derivatives 豪夫迈·罗氏有限公司 2024-10-25 — — CN 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
EP-4308572-A1 NEW THIENOPYRIMIDINONE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2024-01-24 — — EP disclosed
EP-4308577-A1 NEW THIADIAZOLOPYRIMIDONE 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-20240010659-A1 NEW THIADIAZOLOPYRIMIDONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2024-01-11 — — US disclosed
US-20240002407-A1 THIENOPYRIMIDINONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2024-01-04 — — US disclosed
CN-116997555-A Novel thienopyrimidinone derivatives 豪夫迈·罗氏有限公司 2023-11-03 — — CN disclosed
CN-116981674-A Novel thiazolopyrimidinone derivatives 豪夫迈·罗氏有限公司 2023-10-31 — — CN 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
WO-2022194800-A1 NEW THIENOPYRIMIDINONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2022-09-22 — — WO disclosed
WO-2022194802-A1 NEW THIADIAZOLOPYRIMIDONE 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 (4 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 HTT 1954/4885HPGD 2371/4885HSD17B10 933/4885
US-20240010659-A1 NEW THIADIAZOLOPYRIMIDONE DERIVATIVES TBXA2R, ADRA1D, TBXAS1 HTT 3183/4885HPGD 1013/4885HSD17B10 1734/4885
US-20240002407-A1 THIENOPYRIMIDINONE DERIVATIVES XDH, P2RX4, TBXA2R HTT 2120/4885HPGD 865/4885HSD17B10 2601/4885
US-20250179092-A1 PYRIDO[1,2-A]PYRIMIDIN-4-ONE DERIVATIVES ADORA1, P2RY1, CCNA1 HTT 2577/4885HPGD 706/4885HSD17B10 3473/4885

“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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