SCHEMBL5159801

SCHEMBL5159801

N#CO[PH](=O)OC#N

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL30617899 0.72
SCHEMBL5159803 0.72
SCHEMBL29040949 0.71
SCHEMBL3891179 0.61
Acetonitrile SCHEMBL11346565 0.57
SCHEMBL1074817 0.56
SCHEMBL265245 0.53
SCHEMBL265246 0.50
SCHEMBL27793276 0.50
SCHEMBL4529837 0.49

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-0366560-A1 Tylosin derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1990-05-02 EP claimed
CN-119528979-A Multifunctional organic semiconductor material with cyanophosphonic acid as anchoring group, and preparation method and application thereof 淮阴工学院 2025-02-28 CN disclosed
CN-119528979-A Multifunctional organic semiconductor material with cyanophosphonic acid as anchoring group, and preparation method and application thereof 淮阴工学院 2025-02-28 CN disclosed
CN-119504855-A Strong-adsorption super-wetting self-assembled small molecule and preparation method and application thereof 厦门中科晏阳新材料有限公司 2025-02-25 CN disclosed
CN-119462742-A Pyrene nucleus self-assembled monolayer-based organic semiconductor material, and preparation method and application thereof 淮阴工学院 2025-02-18 CN disclosed
CN-118724948-A Dual-function self-assembled hole transport material and preparation method and application thereof 深圳普太科技有限公司 2024-10-01 CN disclosed
CN-116528598-A Perovskite laminated cell 上海辉纳思光电科技有限公司 2023-08-01 CN disclosed
CN-106432329-B A kind of beta-cyano phosphono analog derivative and the preparation method and application thereof 苏州大学 2018-07-31 CN disclosed
CN-106432329-B A kind of beta-cyano phosphono analog derivative and the preparation method and application thereof 苏州大学 2018-07-31 CN disclosed
EP-1133474-B1 3-SUBSTITUTED-4-ARYLQUINOLIN-2-ONE DERIVATIVES AS POTASSIUM CHANNEL MODULATORS BRISTOL MYERS SQUIBB CO (US) 2007-02-21 EP disclosed
EP-1133474-A4 3-SUBSTITUTED-4-ARYLQUINOLIN-2-ONE DERIVATIVES AS POTASSIUM CHANNEL MODULATORS BRISTOL MYERS SQUIBB CO (US) 2005-02-16 EP disclosed
US-6852663-B2 Double-metal cyanide catalysts for preparing polyether polyols BAYER AKTIENGESELLSCHAFT (DE) 2005-02-08 US disclosed
US-20030119663-A1 Double-metal cyanide catalysts for preparing polyether polyols BAYER AKTIENGESELLSCHAFT (DE) 2003-06-26 US disclosed
EP-1133474-A1 3-SUBSTITUTED-4-ARYLQUINOLIN-2-ONE DERIVATIVES AS POTASSIUM CHANNEL MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2001-09-19 EP disclosed
US-6184231-B1 NEUROPROTECTANTS; TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS, TRAUMATIC BRAIN INJURY, SEXUAL DYSFUNCTION BRISTOL-MYERS SQUIBB 2001-02-06 US disclosed
EP-1064289-A1 HETEROCYCLIC SIGNAL TRANSDUCTION INHIBITORS, COMPOSITIONS CONTAINING THEM ARIAD PHARMACEUTICALS, INC. (US) 2001-01-03 EP disclosed
WO-2000034244-A1 3-SUBSTITUTED-4-ARYLQUINOLIN-2-ONE DERIVATIVES AS POTASSIUM CHANNEL MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2000-06-15 WO disclosed
WO-1999047529-A1 HETEROCYCLIC SIGNAL TRANSDUCTION INHIBITORS, COMPOSITIONS CONTAINING THEM ARIAD PHARMACEUTICALS, INC. (US) 1999-09-23 WO disclosed
US-5110921-A Bactericides FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-05-05 US disclosed
EP-0366560-A1 Tylosin derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1990-05-02 EP disclosed