SCHEMBL2805958

SCHEMBL2805958

C=C1C=[C]CCC1

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
SCHEMBL213528 0.67
SCHEMBL3634164 0.67
SCHEMBL10962636 0.62
SCHEMBL14832620 0.59
SCHEMBL313308 0.59 TSHR (0.44)
SCHEMBL5695362 0.58
SCHEMBL101996 0.55
SCHEMBL9498346 0.51
SCHEMBL104277 0.51
SCHEMBL11331916 0.50

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116514678-A Novel coronavirus inhibitor, pharmaceutical composition containing same and use thereof 南开大学 2023-08-01 CN claimed
US-20060154924-A1 Fungicidal mixtures based on morpholine or piperidine derivatives and oxime ether derivatives SCHELBERGER KLAUS 2006-07-13 US claimed
US-7026315-B1 Fungicide mixtures which are based on derivatives of morpholine or piperidine and derivatives oxime ether BASF AKTIENGESELLSCHAFT (DE) 2006-04-11 US claimed
CN-116514678-A Novel coronavirus inhibitor, pharmaceutical composition containing same and use thereof 南开大学 2023-08-01 CN disclosed
US-8410247-B2 Water-soluble phosphinothiol reagents WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2013-04-02 US disclosed
US-20100048866-A1 WATER-SOLUBLE PHOSPHINOTHIOL REAGENTS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-02-25 US disclosed
US-20060154924-A1 Fungicidal mixtures based on morpholine or piperidine derivatives and oxime ether derivatives SCHELBERGER KLAUS 2006-07-13 US disclosed
US-7026315-B1 Fungicide mixtures which are based on derivatives of morpholine or piperidine and derivatives oxime ether BASF AKTIENGESELLSCHAFT (DE) 2006-04-11 US disclosed
EP-1201127-B1 Fungicidal mixtures based on pyridine carboxamide compounds BASF AG (DE) 2004-03-31 EP disclosed
EP-1083792-B1 FUNGICIDAL MIXTURES BASF AG (DE) 2003-09-24 EP disclosed
EP-1139749-B1 FUNGICIDE MIXTURES WHICH ARE BASED ON DERIVATIVES OF MORPHOLINE OR PIPERIDINE AND DERIVATIVES OF OXIME ETHER BASF AG (DE) 2003-05-02 EP disclosed
US-6436979-B1 SYNERGISTIC NITROGEN COMPOUNDS, USED FOR CONTROLLING PHYTOPATHOGENS IN PLANTS, SOILS AND SEEDS BASF AKTIENGESELLSCHAFT (DE) 2002-08-20 US disclosed
EP-1201127-A1 Fungicidal mixtures based on pyridine carboxamide compounds BASF AKTIENGESELLSCHAFT (DE) 2002-05-02 EP disclosed
US-6346538-B1 SYNERGISTIC; CONTROLLING POWDERY MILDEW IN GRAPEVINES, CEREALS, AND VEGETABLES BASF AKTIENGESELLSCHAFT (DE) 2002-02-12 US disclosed
EP-1139749-A1 FUNGICIDE MIXTURES WHICH ARE BASED ON DERIVATIVES OF MORPHOLINE OR PIPERIDINE AND DERIVATIVES OF OXIME ETHER BASF AKTIENGESELLSCHAFT (DE) 2001-10-10 EP disclosed
EP-1083792-A1 FUNGICIDAL MIXTURES BASF AKTIENGESELLSCHAFT (DE) 2001-03-21 EP disclosed
EP-1041881-A2 FUNGICIDE MIXTURES BASED ON AMIDE COMPOUNDS AND PYRIDINE DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2000-10-11 EP disclosed
WO-2000036917-A1 FUNGICIDE MIXTURES WHICH ARE BASED ON DERIVATIVES OF MORPHOLINE OR PIPERIDINE AND DERIVATIVES OF OXIME ETHER BASF AKTIENGESELLSCHAFT (DE) 2000-06-29 WO disclosed
WO-1999056551-A1 FUNGICIDAL MIXTURES BASF AKTIENGESELLSCHAFT (DE) 1999-11-11 WO disclosed
WO-1999031980-A2 FUNGICIDE MIXTURES BASED ON PYRIDINE CARBOXAMIDES BASF AKTIENGESELLSCHAFT (DE) 1999-07-01 WO disclosed