SCHEMBL2720536

SCHEMBL2720536

CCN(CC)Cc1cccc(CP(C(C)(C)C)C(C)(C)C)n1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35
GRIN2C Q14957 1/20 0.35
GRIN3A Q8TCU5 1/20 0.35
CCR4 P51679 1/20 0.35
KCNH2 Q12809 1/20 0.33
HRH3 Q9Y5N1 1/20 0.32

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
SCHEMBL30460623 1.00 GRIN2D (0.35) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL21530767 0.98 GRIN2D (0.34) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31166293 0.98 GRIN2D (0.34) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Carbon Monoxide SCHEMBL30850523 0.92 CCR4 (0.31) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Formaldehyde SCHEMBL30981585 0.92 CCR4 (0.31) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1467841 0.84 KCNH2 (0.38) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29519505 0.82 KCNH2 (0.36) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL522437 0.82 GRIN2D (0.44) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL21357624 0.81 KCNH2 (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL15850947 0.78 KCNH2 (0.35) KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025030180-A1 CATALYST AND PROCESS FOR LOW CARBON INTENSITY DIESEL FUEL PRODUCTION CHEVRON U.S.A. INC. (US) 2025-02-06 WO disclosed
EP-3994117-B1 HYDROGENATION OF ESTERS TO ALCOHOLS IN THE PRESENCE OF A RU-PNN COMPLEX BASF SE (DE) 2024-07-03 EP disclosed
CN-117917412-A Process for preparing chiral lactones 帝斯曼知识产权资产管理有限公司 2024-04-23 CN disclosed
CN-111757874-B Methods for preparing modulators of cystic fibrosis transmembrane conductance regulator 弗特克斯药品有限公司 2024-03-08 CN disclosed
CN-114080379-B Hydrogenation of esters to alcohols in the presence of Ru-PNN complexes 巴斯夫欧洲公司 2024-02-23 CN disclosed
US-20230374195-A1 Value Chain Return Process for Spent Polyurethanes by Hydrogenation BASF SE (DE) 2023-11-23 US disclosed
US-20230374254-A1 Value Chain Return Process for Spent Polyamides by Hydrogenation BASF SE (DE) 2023-11-23 US disclosed
US-20230372915-A1 MANGANESE BASED COMPLEXES AND USES THEREOF FOR HOMOGENEOUS CATALYSIS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2023-11-23 US disclosed
CN-117083259-A Selective catalytic olefin isomerization for the manufacture of perfume ingredients or intermediates 国际香精香料公司 2023-11-17 CN disclosed
US-11731116-B2 Manganese based complexes and uses thereof for homogeneous catalysis YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2023-08-22 US disclosed
US-20140182483-A1 Titanium Containing Hydrosilylation Catalysts And Compositions Containing The Catalysts DOW CORNING CORPORATION 2014-07-03 US disclosed
US-20140163225-A1 CATALYSTS AND PROCESSES FOR THE HYDROGENATION OF AMIDES THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2014-06-12 US disclosed
EP-2734299-A1 CATALYSTS AND PROCESSES FOR THE HYDROGENATION OF AMIDES The Governors of the University of Alberta (CA) 2014-05-28 EP disclosed
US-20130281664-A1 NOVEL RUTHENIUM COMPLEXES AND THEIR USES IN PROCESSES FOR FORMATION AND/OR HYDROGENATION OF ESTERS, AMIDES AND DERIVATIVES THEREOF YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2013-10-24 US disclosed
WO-2013128477-A1 PROCESS FOR PRODUCING AMIDE COMPOUNDS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2013-09-06 WO disclosed
EP-2629889-A2 NOVEL RUTHENIUM COMPLEXES AND THEIR USES IN PROCESSES FOR FORMATION AND/OR HYDROGENATION OF ESTERS, AMIDES AND DERIVATIVES THEREOF Yeda Research and Development Co. Ltd. (IL) 2013-08-28 EP disclosed
WO-2013043783-A2 COBALT CONTAINING HYDROSILYLATION CATALYSTS AND COMPOSITIONS CONTAINING THE CATALYSTS DOW CORNING CORPORATION (US) 2013-03-28 WO disclosed
WO-2013043785-A2 NICKEL CONTAINING HYDROSILYLATION CATALYSTS AND COMPOSITIONS CONTAINING THE CATALYSTS DOW CORNING CORPORATION (US) 2013-03-28 WO disclosed
WO-2013010275-A1 CATALYSTS AND PROCESSES FOR THE HYDROGENATION OF AMIDES THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2013-01-24 WO disclosed
WO-2012052996-A2 NOVEL RUTHENIUM COMPLEXES AND THEIR USES IN PROCESSES FOR FORMATION AND/OR HYDROGENATION OF ESTERS, AMIDES AND DERIVATIVES THEREOF YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2012-04-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230372915-A1 MANGANESE BASED COMPLEXES AND USES THEREOF FOR HOMOGENEOUS CATALYSIS ADH1C, OTC, MLEC GRIN2D 1746/4885GRIN3B 1573/4885GRIN1 1032/4885
US-20140163225-A1 CATALYSTS AND PROCESSES FOR THE HYDROGENATION OF AMIDES KAT2A, NAAA, KAT8 GRIN2D 814/4885GRIN3B 928/4885GRIN1 303/4885
US-20140182483-A1 Titanium Containing Hydrosilylation Catalysts And Compositions Containing The Catalysts ITGA1, TMT1A, ITGA2 GRIN2D 548/4885GRIN3B 291/4885GRIN1 98/4885
US-20130281664-A1 NOVEL RUTHENIUM COMPLEXES AND THEIR USES IN PROCESSES FOR FORMATION AND/OR HYDROGENATION OF ESTERS, AMIDES AND DERIVATIVES THEREOF ADH5, ADH1C, ADH1A GRIN2D 3054/4885GRIN3B 3399/4885GRIN1 2748/4885
US-11731116-B2 Manganese based complexes and uses thereof for homogeneous catalysis ADH1C, OTC, ADH5 GRIN2D 1772/4885GRIN3B 1494/4885GRIN1 1104/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.