SCHEMBL29479366

SCHEMBL29479366

COc1cc(-c2cc(Cl)ccc2-n2cc(Cl)nn2)c(OC)cn1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ F11 P03951 20/20 0.48
▸ KLKB1 P03952 19/20 0.48
▸ CYP3A4 P08684 2/20 0.45

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
SCHEMBL21357425 1.00 F11 (0.48) F11KLKB1CYP3A4
SCHEMBL29227906 0.89 F11 (0.43) F11KLKB1CYP3A4
SCHEMBL30994984 0.89 F11 (0.43) F11KLKB1CYP3A4
SCHEMBL30656519 0.89 F11 (0.39) F11KLKB1CYP3A4
SCHEMBL29089482 0.89 F11 (0.39) F11KLKB1CYP3A4
SCHEMBL28514407 0.88 F11 (0.43) F11KLKB1CYP3A4
SCHEMBL24633462 0.87 F11 (0.46) F11KLKB1CYP3A4
SCHEMBL21357595 0.86 F11 (0.49) F11KLKB1CYP3A4
SCHEMBL24633281 0.86 F11 (0.50) F11KLKB1CYP3A4
SCHEMBL29697761 0.86 F11 (0.49) F11KLKB1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3765452-B1 PREPARATIVE PROCESS OF TWO 4-{[(2S)-2-{4-[5-CHLORO-2-(1H-1,2,3-TRIAZOL-1-YL)PHENYL]-5-METHOXY-2-OXOPYRIDIN-1(2H)-YL}BUTANOYL]AMINO}-2-FLUOROBENZAMIDE DERIVATIVES BAYER AG (DE) 2022-04-13 — — EP claimed
CN-116134025-B Amide phosphine oxide derivative and preparation method and application thereof 浙江海正药业股份有限公司 2025-04-04 — — CN disclosed
CN-118406037-B Triazole derivative and preparation method and application thereof 四川师范大学 2025-02-25 — — CN disclosed
CN-116283750-B Heterocyclic amide derivative and preparation method and application thereof 成都泰和伟业生物科技有限公司 2025-02-07 — — CN disclosed
CN-118406037-A Triazole derivative and preparation method and application thereof 四川师范大学 2024-07-30 — — CN disclosed
CN-117586284-A Macrocyclic compound, and preparation method and application thereof 深圳信立泰药业股份有限公司 2024-02-23 — — CN disclosed
CN-111770917-B Process for the preparation of two compounds 拜耳股份公司 2023-09-26 — — CN disclosed
CN-116283750-A Heterocyclic amide derivative and preparation method and application thereof 成都泰和伟业生物科技有限公司 2023-06-23 — — CN disclosed
CN-116134025-A Amide phosphine oxide derivative and preparation method and application thereof 浙江海正药业股份有限公司 2023-05-16 — — CN disclosed
WO-2022057858-A1 AMIDE PHOSPHINE OXIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF 浙江海正药业股份有限公司 2022-03-24 — — WO disclosed
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