SCHEMBL20161261

SCHEMBL20161261

O=CN1N=CC[C@H]1c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 19/20 0.51
▸ ALDH1A1 P00352 1/20 0.44

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
SCHEMBL28689541 1.00 RIPK1 (0.51) RIPK1ALDH1A1
SCHEMBL20138345 1.00 RIPK1 (0.51) RIPK1ALDH1A1
Hydrochloric Acid SCHEMBL28469788 0.98 RIPK1 (0.50) RIPK1ALDH1A1
Trifluoroacetic Acid SCHEMBL23801079 0.88 RIPK1 (0.52) RIPK1
SCHEMBL28476136 0.82 RIPK1 (0.54) RIPK1ALDH1A1
SCHEMBL28629177 0.81 RIPK1 (0.55) RIPK1ALDH1A1
SCHEMBL28938984 0.81 ALDH1A1 (0.43) RIPK1ALDH1A1
SCHEMBL30166293 0.81 RIPK1 (0.55) RIPK1ALDH1A1
SCHEMBL28971796 0.77 RIPK1 (0.53) RIPK1ALDH1A1
SCHEMBL22638823 0.76 RIPK1 (0.51) RIPK1ALDH1A1

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
CN-113767092-B Di-heterocyclic carbonyl substituted dihydropyrazoles, their preparation and their use in medicine 劲方医药科技(上海)有限公司 2024-07-16 — — CN disclosed
US-20230203027-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF GENZYME CORPORATION 2023-06-29 — — US disclosed
CN-113767092-A Bis-heterocyclic carbonyl substituted dihydropyrazole compound, preparation method and medical application thereof 劲方医药科技(上海)有限公司 2021-12-07 — — CN disclosed
WO-2020224656-A1 BISHETEROCYCLIC CARBONYL SUBSTITUTED DIHYDROPYRAZOLE COMPOUND, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF 劲方医药科技(上海)有限公司 2020-11-12 — — WO disclosed
US-10590085-B2 Heterocyclic amides as kinase inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-03-17 — — US disclosed
CN-110573504-A heterocyclic amides as kinase inhibitors 葛兰素史克知识产权开发有限公司 2019-12-13 — — CN disclosed
US-20180134665-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-05-17 — — US 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 (3 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-10590085-B2 Heterocyclic amides as kinase inhibitors MAP3K19, MAP3K20, MAP3K1 RIPK1 414/4885ALDH1A1 1542/4885
US-20230203027-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF RIPK1, RIPK2, RIPK3 RIPK1 1/4885ALDH1A1 4315/4885
US-20180134665-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS MAP3K19, MAP3K20, MAP3K1 RIPK1 414/4885ALDH1A1 1542/4885

“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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