SCHEMBL367554

SCHEMBL367554

PC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 5/20 0.44
GRIN3B O60391 5/20 0.44
GRIN1 Q05586 5/20 0.44
GRIN2A Q12879 5/20 0.44
GRIN2B Q13224 5/20 0.44
GRIN2C Q14957 5/20 0.44
GRIN3A Q8TCU5 5/20 0.44
LMNA P02545 2/20 0.44
SLC22A2 O15244 2/20 0.44
SLC47A1 Q96FL8 2/20 0.44
SLC22A1 O15245 1/20 0.44
TSHR P16473 1/20 0.44
NFKB1 P19838 1/20 0.44
STAT6 P42226 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
POLB P06746 1/20 0.42
THRB P10828 1/20 0.42
BLM P54132 1/20 0.42
PMP22 Q01453 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
Hydrochloric Acid SCHEMBL27725580 0.96 LMNA (0.47) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Butane SCHEMBL28124633 0.83 GRIN2D (0.35) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL27159088 0.79 GAA (0.44) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Diethylamine SCHEMBL27873091 0.79 TP53 (0.38) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL12877021 0.68 TSHR (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL963771 0.67 GRIN2D (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL3915588 0.67 LMNA (0.47) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1456672 0.65
SCHEMBL31718014 0.62 LMNA (0.43) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL16311149 0.62 LMNA (0.43) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119306765-A Adamantyl phosphine ligand of cinchona alkaloid skeleton, silver catalyst containing ligand and application of ligand 浙江工业大学 2025-01-14 CN claimed
CN-119118821-A Rare earth carboxylic acid complex, preparation method and application thereof 包头稀土研究院 2024-12-13 CN claimed
CN-118271259-A Organic single-molecule white light material based on 1,3, 5-triphenoxazine/thia/selenazine arene olefination 重庆大学 2024-07-02 CN claimed
CN-117447394-A Synthesis process of 2-isopropyl-4-methylpyridine-3-amine 苏利制药科技江阴有限公司 2024-01-26 CN claimed
CN-117327007-A VT107 preparation method 上海陶术生物科技有限公司 2024-01-02 CN claimed
EP-3766891-B1 TRIARYL PHOSPHINE LIGANDS, PREPARATION METHOD THEREFOR, AND USE IN CATALYSING COUPLING REACTIONS DONGGUAN STEPHEN CATALYST CO LTD (CN) 2023-11-01 EP claimed
CN-116813528-A Synthesis method of all-carbon quaternary carbon cyclic ketone spiro indolenine derivative 江苏海洋大学 2023-09-29 CN claimed
WO-2023161841-A1 CHIRAL (P, N)-LIGAND FOR METAL COMPLEXES AND METHOD OF PREPARATION THEREOF Indian Institute Of Science Education And Research Bhopal (IN) 2023-08-31 WO claimed
CN-116514663-A Preparation method of 3',4',5 '-trifluoro-2-nitro-1, 1' -biphenyl 顺毅南通化工有限公司 2023-08-01 CN claimed
EP-4180043-A1 RUTHENIUM COMPLEXES Universidad de Almeria (ES) 2023-05-17 EP claimed
CN-101809059-B Method for the production of thiophene oligomers BAYER TECHNOLOGY SERVICES GMBH 2012-08-29 CN claimed
CN-102127135-A Preparation method of pyrimidine nucleoside compound or purine nucleoside compound SHANGHAI INST ORGANIC CHEM 2011-07-20 CN claimed
EP-1303525-B1 PRODUCTION OF NOVEL PHOSPHANE LIGANDS AND USE IN CATALYTICAL REACTIONS EVONIK DEGUSSA GMBH (DE) 2010-09-08 EP claimed
CN-101809059-A Method for the production of thiophene oligomers BAYER TECHNOLOGY SERVICES GMBH 2010-08-18 CN claimed
CN-101778883-A Method for producing polythiophenes and oligothiophenes on an industrial scale BAYER TECHNOLOGY SERVICES GMBH 2010-07-14 CN claimed
CN-101687982-A Method for synthesizing oligo/polythiophenes by a \"one pot\" synthesis route BAYER TECHNOLOGY SERVICES GMBH 2010-03-31 CN claimed
CN-101195641-A Novel phosphine ligand, production and uses in catalytic reaction thereof AIVONYIKDEGUSA CO LTD (DE) 2008-06-11 CN claimed
CN-101142204-A Improved method for Kumada coupling reaction HONEYWELL INT INC (US) 2008-03-12 CN claimed
CN-101142254-A Halogenated thiophene monomer for the preparation of regioregular polythiophenes HONEYWELL INT INC (US) 2008-03-12 CN claimed
US-20040068131-A1 (adamantyl)nP(alkyl)m(1a); (adamantyl)o(Alkyl)qP (alkylene')P(adamantyl)r(alkyl)s , wherein adamantyl bonded to phosphorus atom in position 1, or 2, useful for refining halogenoaromatics EVONIK DEGUSSA GMBH (DE) 2004-04-08 US claimed

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

For each of this compound's patents that has machine-readable text (1 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-20040068131-A1 (adamantyl)nP(alkyl)m(1a); (adamantyl)o(Alkyl)qP (alkylene')P(adamantyl)r(alkyl)s , wherein adamantyl bonded to phosphorus atom in position 1, or 2, useful for refining halogenoaromatics NAPEPLD, NAPA, APBA1 GRIN2D 1630/4885GRIN3B 2849/4885GRIN1 1180/4885

“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.