SCHEMBL2198265

SCHEMBL2198265

C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.Cl[Pd]Cl

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
SCHEMBL111336 1.00
SCHEMBL30176226 0.97
SCHEMBL21840207 0.97
SCHEMBL29130639 0.97
SCHEMBL28369504 0.88
SCHEMBL301767 0.87 ALDH1A1 (0.33)
SCHEMBL26953 0.87 ALDH1A1 (0.33)
SCHEMBL22157999 0.87 ALDH1A1 (0.33)
SCHEMBL14675991 0.87 ALDH1A1 (0.33)
SCHEMBL3175920 0.87 ALDH1A1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116710445-A Biphenyl compound as immunomodulator as well as preparation method and application thereof 深圳微芯生物科技股份有限公司 2023-09-05 CN claimed
CN-115433212-A Biphenyl compound as immunomodulator and preparation method and application thereof 深圳微芯生物科技股份有限公司 2022-12-06 CN claimed
CN-107118781-B A kind of synthetic method of liquid crystal media 浙江工业大学 2019-11-12 CN claimed
CN-106749911-B Norborneol alkenes, tetrafluoroethene and N-phenylmaleimide ternary polymerization catalyst and method for ternary polymerization 宁波工程学院 2019-03-29 CN claimed
CN-107175134-B It is a kind of to be used to prepare 3-aminophenylacetylene or the composition of its salt and application thereof 成都西岭源药业有限公司 2018-03-23 CN claimed
CN-107382786-A Oligomerization phenylene ethylene compound and its preparation method and application 中国科学院化学研究所 2017-11-24 CN claimed
CN-107382995-A One pot process safe ground azoles amine 杭州新博思生物医药有限公司 2017-11-24 CN claimed
CN-104974073-B A kind of method for preparing Silodosin intermediate 江苏和成新材料有限公司 2017-11-03 CN claimed
CN-105481662-B The method for preparing the intermediate for producing the liquid-crystal compounds containing difluoro-methoxy 江苏和成新材料有限公司 2017-10-24 CN claimed
CN-107175134-A It is a kind of to be used to prepare 3-aminophenylacetylene or the composition of its salt and application thereof 成都西岭源药业有限公司 2017-09-19 CN claimed
CN-103044386-A Bifluoranthene-containing organic semiconductor material as well as preparation method and application thereof OCEANS KING LIGHTING SCIENCE 2013-04-17 CN claimed
CN-103030566-A Fluoranthene organic semiconductor material and preparing method and application thereof OCEANS KING LIGHTING SCIENCE 2013-04-10 CN claimed
CN-103012206-A Double-fluoranthene organic semiconductor material as well as preparation method and application thereof OCEANS KING LIGHTING SCIENCE 2013-04-03 CN claimed
CN-103012163-A Double-fluoranthene organic semiconductor material as well as preparation method and application thereof OCEANS KING LIGHTING SCIENCE 2013-04-03 CN claimed
CN-102977151-A Method for preparing bis(tricyclohexylphosphine) palladium dichloride BEIJING GREENCHEM TECHNOLOGY CO LTD 2013-03-20 CN claimed
CN-102924296-A Fluoranthene-containing organic compound, preparation method and application thereof OCEANS KING LIGHTING SCIENCE 2013-02-13 CN claimed
CN-102757376-A Preparation method of b-heterocyclic ketone compound UNIV DALIAN TECH 2012-10-31 CN claimed
US-7977360-B2 Benzo[d]isoxazol-3-yl-amine compounds and their use as vanilloid receptor ligands GRUENENTHAL GMBH (DE) 2011-07-12 US claimed
EP-1888541-B1 BENZO(D)ISOXAZOL-3-YL-AMINE COMPOUNDS AND THEIR USE AS VANILLOID RECEPTOR LIGANDS GRUENENTHAL GMBH (DE) 2009-08-05 EP claimed
US-20090042945-A1 Benzo[d]isoxazol-3-yl-amine Compounds and Their Use as Vanilloid Receptor Ligands GRUENENTHAL GMBH (DE) 2009-02-12 US claimed