SCHEMBL804499

SCHEMBL804499

CP(C)(=O)CC#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
SCHEMBL9814651 0.75
SCHEMBL9816012 0.75
Hydrochloric Acid SCHEMBL10332240 0.73
SCHEMBL13656119 0.69
SCHEMBL16978999 0.69
SCHEMBL9359483 0.69
SCHEMBL11572792 0.69
SCHEMBL1127967 0.67
SCHEMBL170190 0.67
SCHEMBL9814682 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116262728-B Pure organic room temperature phosphorescent material regulated and controlled through flexible chains, and preparation method and application thereof 武汉大学 2024-09-10 CN claimed
CN-116262728-A Pure organic room temperature phosphorescent material regulated and controlled through flexible chains, and preparation method and application thereof 武汉大学 2023-06-16 CN claimed
CN-113214155-B Long-life pure organic room-temperature phosphorescent material and preparation method and application thereof 武汉大学 2022-10-11 CN claimed
CN-113214155-A Long-life pure organic room-temperature phosphorescent material and preparation method and application thereof 武汉大学 2021-08-06 CN claimed
CN-116262728-B Pure organic room temperature phosphorescent material regulated and controlled through flexible chains, and preparation method and application thereof 武汉大学 2024-09-10 CN disclosed
CN-116262728-A Pure organic room temperature phosphorescent material regulated and controlled through flexible chains, and preparation method and application thereof 武汉大学 2023-06-16 CN disclosed
CN-113214155-B Long-life pure organic room-temperature phosphorescent material and preparation method and application thereof 武汉大学 2022-10-11 CN disclosed
CN-113214155-A Long-life pure organic room-temperature phosphorescent material and preparation method and application thereof 武汉大学 2021-08-06 CN disclosed
US-20180224577-A1 SECOND-ORDER NONLINEAR OPTICAL COMPOUND AND NONLINEAR OPTICAL ELEMENT COMPRISING THE SAME NATIONAL INSTITUTE OF INFORMATION AND COMMUNICATIONS TECHNOLOGY (JP) 2018-08-09 US disclosed
US-20180221374-A1 DEUTERATED BARICITINIB SUN PHARMACEUTICAL INDUSTRIES, INC. 2018-08-09 US disclosed
US-20180179209-A1 JAK INHIBITORS Wuxi Fortune Pharmaceutical Co., Ltd (CN) 2018-06-28 US disclosed
US-9977150-B2 Second-order nonlinear optical compound and nonlinear optical element comprising the same NATIONAL INSTITUTE OF INFORMATION AND COMMUNICATIONS TECHNOLOGY (JP) 2018-05-22 US disclosed
US-8569521-B2 Benzenesulfonyl-chromane, thiochromane, tetrahydronaphthalene and related gamma secretase inhibitors MERCK SHARP & DOHME CORP. (US) 2013-10-29 US disclosed
US-20130071415-A1 Heterocyclic Compounds as Janus Kinase Inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2013-03-21 US disclosed
US-20120264736-A1 BENZENESULFONYL-CHROMANE, THIOCHROMANE, TETRAHYDRONAPHTHALENE AND RELATED GAMMA SECRETASE INHIBITORS SCHERING CORPORATION (US) 2012-10-18 US disclosed
US-20120172599-A1 SECOND-ORDER NONLINEAR OPTICAL COMPOUND AND NONLINEAR OPTICAL ELEMENT COMPRISING THE SAME SUMITOMO ELECTRIC INDUSTRIES, LTD. (JP) 2012-07-05 US disclosed
US-20120149662-A1 Heterocyclic Compounds as Janus Kinase Inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2012-06-14 US disclosed
US-20120071673-A1 SYNTHESIS OF (S)-N-[2-(1,6,7,8-TETRAHYDRO-2H-INDENO-[5,4-B]FURAN-8-YL)ETHYL]PROPIONAMIDE LEK PHARMACEUTICALS D.D. (SI) 2012-03-22 US disclosed
US-8110683-B2 Piperidinyl compounds that selectively bind integrins JANSSEN PHARMACEUTICA N.V. (BE) 2012-02-07 US disclosed
US-20110092528-A1 PIPERIDINYL COMPOUNDS THAT SELECTIVELY BIND INTEGRINS DE CORTE BART 2011-04-21 US disclosed