SCHEMBL2271671

SCHEMBL2271671

BrC12CC3CC(C1)CC(Br)(C3)C2(Br)Br

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
SLC22A2 O15244 1/20 0.33
SLC22A1 O15245 1/20 0.33
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
STAT6 P42226 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
GRIN3A Q8TCU5 1/20 0.33
SLC47A1 Q96FL8 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
POLB P06746 1/20 0.32
THRB P10828 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL7121406 0.67 GRIN2D (0.35) LMNASLC22A2SLC22A1GRIN2DGRIN3B
SCHEMBL18028703 0.67 LMNA (0.34) LMNASLC22A2SLC22A1GRIN2DGRIN3B
SCHEMBL548532 0.67 LMNA (0.34) LMNASLC22A2SLC22A1GRIN2DGRIN3B
SCHEMBL22981789 0.65
SCHEMBL16930788 0.65 LMNA (0.32) LMNASLC22A2SLC22A1GRIN2DGRIN3B
SCHEMBL16930786 0.65 LMNA (0.32) LMNASLC22A2SLC22A1GRIN2DGRIN3B
SCHEMBL8680357 0.65 GRIN2D (0.44) LMNASLC22A2SLC22A1GRIN2DGRIN3B
SCHEMBL258925 0.65 GRIN2D (0.44) LMNASLC22A2SLC22A1GRIN2DGRIN3B
SCHEMBL1930949 0.64 GRIN2D (0.33) LMNASLC22A2SLC22A1GRIN2DGRIN3B
SCHEMBL16930787 0.63 GRIN2D (0.32) LMNASLC22A2SLC22A1GRIN2DGRIN3B

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-107324978-B Biphenyl substituted adamantane derivative monomolecular resin, positive photoresist composition and negative photoresist composition 中国科学院理化技术研究所 2020-10-02 CN disclosed
CN-107266319-B Dendritic polyphenyl substituted adamantane derivative monomolecular resin, positive photoresist composition and negative photoresist composition 中国科学院理化技术研究所 2020-04-24 CN disclosed
US-20110200536-A1 CHELATORS, PARAMAGNETIC CHELATES THEREOF AND THEIR USE AS CONTRAST AGENTS IN MAGNETIC RESONANCE IMAGING (MRI) GE HEALTHCARE AS (NO) 2011-08-18 US disclosed
EP-2178862-A1 CHELATORS, PARAMAGNETIC CHELATES THEREOF AND THEIR USE AS CONTRAST AGENTS IN MAGNETIC RESONANCE IMAGING (MRI) GE Healthcare AS (NO) 2010-04-28 EP disclosed
US-20100008864-A1 AROMATIC MULTIMERS MEIJER ANDREAS 2010-01-14 US disclosed
WO-2009021948-A1 CHELATORS, PARAMAGNETIC CHELATES THEREOF AND THEIR USE AS CONTRAST AGENTS IN MAGNETIC RESONANCE IMAGING (MRI) GE HEALTHCARE AS (NO) 2009-02-19 WO disclosed
EP-1274755-B1 LOW DIELECTRIC CONSTANT ORGANIC DIELECTRICS BASED ON CAGE-LIKE STRUCTURES HONEYWELL INT INC (US) 2008-02-20 EP disclosed
US-7049386-B2 Compositions and methods for thermosetting molecules in organic compositions HONEYWELL INTERNATIONAL INC. (US) 2006-05-23 US disclosed
US-20060063834-A1 Substituted adamantanes, and methods of making the same MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2006-03-23 US disclosed
US-6987147-B2 Low dielectric constant materials with improved thermo-mechanical strength and processability HONEYWELL INTERNATIONAL INC. (US) 2006-01-17 US disclosed
EP-1309639-A1 COMPOSITIONS AND METHODS FOR THERMOSETTING MOLECULES IN ORGANIC COMPOSITIONS Honeywell International, Inc. (US) 2003-05-14 EP disclosed
US-20030060590-A1 Producing a low dielectric constant polymer from a thermosetting monomer that has a cage compound or aryl core structure, which is covalently bound to a plurality of arms that contain acetylenic groups HONEYWELL INTERNATIONAL INC. 2003-03-27 US disclosed
WO-2003007337-A2 LOW DIELECTRIC CONSTANT ORGANIC DIELECTRICS BASED ON CAGE-LIKE STRUCTURES HONEYWELL INTERNATIONAL INC. (US) 2003-01-23 WO disclosed
US-6509415-B1 Crosslinked polyphenylene ethers with cage compounds attached; integrated circuits HONEYWELL INTERNATIONAL INC. 2003-01-21 US disclosed
EP-1274755-A2 LOW DIELECTRIC CONSTANT ORGANIC DIELECTRICS BASED ON CAGE-LIKE STRUCTURES Honeywell International Inc. (US) 2003-01-15 EP disclosed
US-6469123-B1 THERMOSETTING MONOMER IS INCORPORATED INTO A POLYMER TO FORM THE LOW DIELECTRIC CONSTANT POLYMER; CAGE COMPOUNDS AND CORE STRUCTURES INCLUDE ADAMANTANE, DIAMANTANE, SILICON, A PHENYL GROUP AND A SEXIPHENYLENE HONEYWELL INTERNATIONAL INC. 2002-10-22 US disclosed
US-20020022708-A1 Compositions and methods for thermosetting molecules in organic compositions HONEYWELL INTERNATIONAL INC. 2002-02-21 US disclosed
US-20020016414-A1 Low dielectric constant organic dielectrics based on cage-like structures HONEYWELL INTERNATIONAL INC. 2002-02-07 US disclosed
WO-2002008308-A1 COMPOSITIONS AND METHODS FOR THERMOSETTING MOLECULES IN ORGANIC COMPOSITIONS HONEYWELL INTERNATIONAL INC. (US) 2002-01-31 WO disclosed
WO-2001078110-A2 LOW DIELECTRIC CONSTANT ORGANIC DIELECTRICS BASED ON CAGE-LIKE STRUCTURES HONEYWELL INTERNATIONAL INC. (US) 2001-10-18 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 (3 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-20100008864-A1 AROMATIC MULTIMERS AHR, ARG2, PAH LMNA 3117/4885SLC22A2 810/4885SLC22A1 994/4885
US-20060063834-A1 Substituted adamantanes, and methods of making the same DDO, SLC18A2, BACE1 LMNA 2023/4885SLC22A2 2354/4885SLC22A1 2461/4885
US-20110200536-A1 CHELATORS, PARAMAGNETIC CHELATES THEREOF AND THEIR USE AS CONTRAST AGENTS IN MAGNETIC RESONANCE IMAGING (MRI) TSPO, PML, AIP LMNA 4069/4885SLC22A2 900/4885SLC22A1 832/4885

“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.