Eclitasertib

Eclitasertib

SCHEMBL19207480

CN1C(=O)C(NC(=O)c2nnc(Cc3ccccc3)[nH]2)COc2cccnc21

nearest known ligand 0.77

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 20/20 0.77
NR1I2 O75469 1/20 0.56
CYP2C9 P11712 1/20 0.56

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
Eclitasertib SCHEMBL19207477 1.00 RIPK1 (0.77) RIPK1NR1I2CYP2C9
Eclitasertib SCHEMBL19224719 1.00 RIPK1 (0.77) RIPK1NR1I2CYP2C9
Eclitasertib SCHEMBL19207584 0.94 RIPK1 (0.69) RIPK1NR1I2CYP2C9
Eclitasertib SCHEMBL19207582 0.94 RIPK1 (0.69) RIPK1NR1I2CYP2C9
SCHEMBL22736926 0.92 RIPK1 (0.66) RIPK1
SCHEMBL22737137 0.92 RIPK1 (0.66) RIPK1
SCHEMBL19207613 0.88 RIPK1 (0.76) RIPK1
SCHEMBL29415769 0.88 RIPK1 (0.76) RIPK1
SCHEMBL19207609 0.88 RIPK1 (0.76) RIPK1
SCHEMBL19224733 0.88 RIPK1 (0.65) RIPK1

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11999750-B2 Crystalline forms of (S)-5-benzyl-N-(5-methyl-4-oxo-2,3,4,5-tetrahydropyrido [3,2-B][1,4]oxazepin-3-yl)-4H-1,2,4-triazole-3-carboxamide DENALI THERAPEUTICS INC. (US) 2024-06-04 US claimed
US-20230271978-A1 CRYSTALLINE FORMS OF (S)-5-BENZYL-N-(5-METHYL-4-OXO-2,3,4,5-TETRAHYDROPYRIDO [3,2-B][1,4]OXAZEPIN-3-YL)-4H-1,2,4-TRIAZOLE-3-CARBOXAMIDE DENALI THERAPEUTICS INC. 2023-08-31 US claimed
WO-2023137035-A1 CRYSTALLINE FORMS OF (S)-5-BENZYL-N-(5-METHYL-4-OXO-2, 3,4,5- TETRAHYDROPYRIDO [3,2-B] [L,4]OXAZEPIN-3-YL)-4H-L,2,4-TRIAZOLE-3-CARBOXAMIDE DENALI THERAPEUTICS INC. (US) 2023-07-20 WO claimed
EP-4135705-A1 ECLITASERTIB FOR USE IN TREATING CONDITIONS INVOLVING SYSTEMIC HYPERINFLAMMATORY RESPONSE GENZYME CORPORATION (US) 2023-02-22 EP claimed
WO-2021211919-A1 ECLITASERTIB FOR USE IN TREATING CONDITIONS INVOLVING SYSTEMIC HYPERINFLAMMATORY RESPONSE GENZYME CORPORATION (US) 2021-10-21 WO claimed
US-12043629-B2 RIP1K inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2024-07-23 US disclosed
US-11999750-B2 Crystalline forms of (S)-5-benzyl-N-(5-methyl-4-oxo-2,3,4,5-tetrahydropyrido [3,2-B][1,4]oxazepin-3-yl)-4H-1,2,4-triazole-3-carboxamide DENALI THERAPEUTICS INC. (US) 2024-06-04 US disclosed
US-11999750-B2 Crystalline forms of (S)-5-benzyl-N-(5-methyl-4-oxo-2,3,4,5-tetrahydropyrido [3,2-B][1,4]oxazepin-3-yl)-4H-1,2,4-triazole-3-carboxamide DENALI THERAPEUTICS INC. (US) 2024-06-04 US disclosed
US-20240150376-A1 Compounds, Compositions and Methods DENALI THERAPEUTICS INC. (US) 2024-05-09 US disclosed
US-20230271978-A1 CRYSTALLINE FORMS OF (S)-5-BENZYL-N-(5-METHYL-4-OXO-2,3,4,5-TETRAHYDROPYRIDO [3,2-B][1,4]OXAZEPIN-3-YL)-4H-1,2,4-TRIAZOLE-3-CARBOXAMIDE DENALI THERAPEUTICS INC. 2023-08-31 US disclosed
US-20230271978-A1 CRYSTALLINE FORMS OF (S)-5-BENZYL-N-(5-METHYL-4-OXO-2,3,4,5-TETRAHYDROPYRIDO [3,2-B][1,4]OXAZEPIN-3-YL)-4H-1,2,4-TRIAZOLE-3-CARBOXAMIDE DENALI THERAPEUTICS INC. 2023-08-31 US disclosed
WO-2023137035-A1 CRYSTALLINE FORMS OF (S)-5-BENZYL-N-(5-METHYL-4-OXO-2, 3,4,5- TETRAHYDROPYRIDO [3,2-B] [L,4]OXAZEPIN-3-YL)-4H-L,2,4-TRIAZOLE-3-CARBOXAMIDE DENALI THERAPEUTICS INC. (US) 2023-07-20 WO disclosed
CN-115867548-A RIP1K inhibitors 里格尔药品股份有限公司 2023-03-28 CN disclosed
US-11584758-B2 RIP1K inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2023-02-21 US disclosed
EP-4126864-A1 RIP1K INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2023-02-08 EP disclosed
US-20210317135-A1 RIP1K INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2021-10-14 US disclosed
WO-2021203011-A1 RIP1K INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2021-10-07 WO disclosed
EP-3414239-A2 INHIBITORS OF RECEPTOR-INTERACTING PROTEIN KINASE 1 Denali Therapeutics Inc. (US) 2018-12-19 EP disclosed
US-9896458-B2 Compounds, compositions and methods DENALI THERAPEUTICS INC. (US) 2018-02-20 US disclosed
WO-2017136727-A2 COMPOUNDS, COMPOSITIONS AND METHODS DENALI THERAPEUTICS INC. (US) 2017-08-10 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 (6 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-11584758-B2 RIP1K inhibitors RIPK1, RIPK2, RIPK3 RIPK1 1/4885NR1I2 1753/4885CYP2C9 4864/4885
US-11999750-B2 Crystalline forms of (S)-5-benzyl-N-(5-methyl-4-oxo-2,3,4,5-tetrahydropyrido [3,2-B][1,4]oxazepin-3-yl)-4H-1,2,4-triazole-3-carboxamide CYP4B1, CYP3A4, HTR3C RIPK1 3343/4885NR1I2 233/4885CYP2C9 84/4885
US-20240150376-A1 Compounds, Compositions and Methods PIK3CA, PLK1, PIK3CB RIPK1 416/4885NR1I2 4071/4885CYP2C9 3496/4885
US-12043629-B2 RIP1K inhibitors RIPK1, RIPK2, RIPK3 RIPK1 1/4885NR1I2 1753/4885CYP2C9 4864/4885
US-20210317135-A1 RIP1K INHIBITORS RIPK1, RIPK2, RIPK3 RIPK1 1/4885NR1I2 1753/4885CYP2C9 4864/4885
US-20230271978-A1 CRYSTALLINE FORMS OF (S)-5-BENZYL-N-(5-METHYL-4-OXO-2,3,4,5-TETRAHYDROPYRIDO [3,2-B][1,4]OXAZEPIN-3-YL)-4H-1,2,4-TRIAZOLE-3-CARBOXAMIDE CYP4B1, CYP3A4, HTR3C RIPK1 3343/4885NR1I2 233/4885CYP2C9 84/4885

“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.