SCHEMBL29767973

SCHEMBL29767973

Nc1nn(C(=O)c2ccccc2Cl)c2nc(N3CCCC3)ccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.52
▸ MAPT P10636 3/20 0.52
▸ TP53 P04637 2/20 0.52
▸ PKM P14618 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ GBA1 P04062 1/20 0.45
▸ F2 P00734 3/20 0.42
▸ BCHE P06276 2/20 0.42
▸ ACHE P22303 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ KMT2A Q03164 6/20 0.41
▸ POLB P06746 2/20 0.41
▸ PARP1 P09874 2/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ RAB9A P51151 1/20 0.37

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
SCHEMBL26675390 1.00 SMN1; SMN2 (0.52) SMN1; SMN2MAPTTP53PKMHTT
SCHEMBL29767951 0.87 GBA1 (0.49) SMN1; SMN2MAPTTP53PKMHTT
SCHEMBL26675388 0.87 GBA1 (0.49) SMN1; SMN2MAPTTP53PKMHTT
SCHEMBL26675414 0.84 HSD17B10 (0.47) SMN1; SMN2MAPTTP53PKMHTT
SCHEMBL29767967 0.84 HSD17B10 (0.47) SMN1; SMN2MAPTTP53PKMHTT
SCHEMBL26675419 0.83 SMN1; SMN2 (0.50) SMN1; SMN2MAPTTP53PKMHTT
SCHEMBL29767978 0.83 SMN1; SMN2 (0.50) SMN1; SMN2MAPTTP53PKMHTT
SCHEMBL29767955 0.82 HSD17B10 (0.47) SMN1; SMN2MAPTTP53PKMHTT
SCHEMBL26675397 0.82 HSD17B10 (0.47) SMN1; SMN2MAPTTP53PKMHTT
SCHEMBL30600530 0.81 SMN1; SMN2 (0.53) SMN1; SMN2MAPTTP53PKMHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4284797-A1 PYRAZOLEAMIDE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2023-12-06 — — EP claimed
CN-116867782-A Pyrazole amide derivative 豪夫迈·罗氏有限公司 2023-10-10 — — CN claimed
WO-2022162034-A1 PYRAZOLEAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2022-08-04 — — WO claimed
US-12630549-B2 Pyrazoleamide derivatives HOFFMANN-LA ROCHE INC. (US) 2026-05-19 — — US disclosed
EP-4284797-A1 PYRAZOLEAMIDE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2023-12-06 — — EP disclosed
US-20230382911-A1 PYRAZOLEAMIDE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-11-30 — — US disclosed
CN-116867782-A Pyrazole amide derivative 豪夫迈·罗氏有限公司 2023-10-10 — — CN disclosed
WO-2022162034-A1 PYRAZOLEAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 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-20230382911-A1 PYRAZOLEAMIDE DERIVATIVES P2RY1, P2RX1, P2RX5 SMN1; SMN2 4421/4885MAPT 3058/4885TP53 3001/4885
US-12630549-B2 Pyrazoleamide derivatives CYP11B2, CYP11B1, ADRA1B SMN1; SMN2 2210/4885MAPT 2409/4885TP53 4794/4885

“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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