SCHEMBL522953

SCHEMBL522953

CN(C)Cc1cccc(CN(C)C)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.44
GRIN2D O15399 2/20 0.43
GRIN3B O60391 2/20 0.43
GRIN1 Q05586 2/20 0.43
GRIN2A Q12879 2/20 0.43
GRIN2B Q13224 2/20 0.43
GRIN2C Q14957 2/20 0.43
GRIN3A Q8TCU5 2/20 0.43
KCNH2 Q12809 3/20 0.41
CHRNB2 P17787 1/20 0.40
CHRNA4 P43681 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38
PGK1 P00558 1/20 0.38
PGK2 P07205 1/20 0.38
HRH4 Q9H3N8 1/20 0.37
CYP1A2 P05177 1/20 0.35

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
SCHEMBL10272748 0.91 GRIN2D (0.42) ALDH1A1TSHRGRIN2DGRIN3BGRIN1
SCHEMBL10959505 0.89 GRIN2D (0.41) ALDH1A1TSHRGRIN2DGRIN3BGRIN1
Hydrochloric Acid SCHEMBL11358612 0.87 GRIN2D (0.40) ALDH1A1TSHRGRIN2DGRIN3BGRIN1
SCHEMBL19509897 0.87 KCNH2 (0.52) ALDH1A1TSHRGRIN2DGRIN3BGRIN1
SCHEMBL6984577 0.86 IRAK4 (0.47) ALDH1A1TSHRIRAK4NOS2CXCR4
SCHEMBL13955396 0.85 CXCR4 (0.37) ALDH1A1TSHRGRIN2DGRIN3BGRIN1
SCHEMBL25987493 0.85 IRAK4 (0.36) ALDH1A1TSHRGRIN2DGRIN3BGRIN1
SCHEMBL11065856 0.84 NOS2 (0.45) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29786265 0.84 HTR7 (0.47) ALDH1A1TSHRGRIN2DGRIN3BGRIN1
SCHEMBL5046128 0.84 PDCD1 (0.41) ALDH1A1TSHRGRIN2DGRIN3BGRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117026295-A COF composite material and preparation method and application thereof 深圳技术大学 2023-11-10 CN claimed
US-20050113543-A1 Alpha, omega-allyl terminated linear poly(methacrylic acid) macromonomers for end-linked hydrogels and method of preparation MORNINGSIDE, COLUMBIA UNIVERSITY OF NY 2005-05-26 US claimed
WO-2003101934-A1 α,φ-ALLYL TERMINATED LINEAR POLY(METHACRYLIC ACID) MACROMONOMERS FOR END-LINKED HYDROGELS AND METHOD OF PREPARATION THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2003-12-11 WO claimed
EP-4406609-A2 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND Day One Biopharmaceuticals, Inc. (US) 2024-07-31 EP disclosed
CN-117026295-A COF composite material and preparation method and application thereof 深圳技术大学 2023-11-10 CN disclosed
US-10989846-B2 Near infrared absorbing composition, near infrared cut filter, method of manufacturing near infrared cut filter, solid image pickup element, camera module, and image display device FUJIFILM CORPORATION (JP) 2021-04-27 US disclosed
EP-3632441-A2 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND Millennium Pharmaceuticals, Inc. (US) 2020-04-08 EP disclosed
US-10184052-B2 Near infrared radiation-absorbing composition, near infrared radiation cut-off filter and production method therefor, and camera module and production method therefor FUJIFILM CORPORATION (JP) 2019-01-22 US disclosed
US-20180188428-A1 NEAR-INFRARED CUT FILTER, METHOD FOR PRODUCING NEAR-INFRARED CUT FILTER, AND SOLID-STATE IMAGING ELEMENT FUJIFILM CORPORATION (JP) 2018-07-05 US disclosed
US-20180188428-A1 NEAR-INFRARED CUT FILTER, METHOD FOR PRODUCING NEAR-INFRARED CUT FILTER, AND SOLID-STATE IMAGING ELEMENT FUJIFILM CORPORATION (JP) 2018-07-05 US disclosed
US-20180175090-A1 NEAR INFRARED ABSORBING COMPOSITION, FILM, NEAR INFRARED CUT FILTER, AND SOLID IMAGE PICKUP ELEMENT FUJIFILM CORPORATION (JP) 2018-06-21 US disclosed
US-8524903-B2 Ruthenium or osmium complexes and their uses as catalysts for water oxidation THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2013-09-03 US disclosed
US-8524903-B2 Ruthenium or osmium complexes and their uses as catalysts for water oxidation THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2013-09-03 US disclosed
EP-2415742-A1 METHOD FOR PRODUCING ALCOHOL COMPOUND AND CATALYST THEREFOR Sumitomo Chemical Company, Limited (JP) 2012-02-08 EP disclosed
US-20120029195-A1 METHOD FOR PRODUCING ALCOHOL COMPOUND AND CATALYST THEREFOR SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-02 US disclosed
US-20110042227-A1 Ruthenium or Osmium Complexes and Their Uses as Catalysts for Water Oxidation THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2011-02-24 US disclosed
US-20110042227-A1 Ruthenium or Osmium Complexes and Their Uses as Catalysts for Water Oxidation THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2011-02-24 US disclosed
US-20110042227-A1 Ruthenium or Osmium Complexes and Their Uses as Catalysts for Water Oxidation THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2011-02-24 US disclosed
US-20050113543-A1 Alpha, omega-allyl terminated linear poly(methacrylic acid) macromonomers for end-linked hydrogels and method of preparation MORNINGSIDE, COLUMBIA UNIVERSITY OF NY 2005-05-26 US disclosed
WO-2003101934-A1 α,φ-ALLYL TERMINATED LINEAR POLY(METHACRYLIC ACID) MACROMONOMERS FOR END-LINKED HYDROGELS AND METHOD OF PREPARATION THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2003-12-11 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 (2 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-20120029195-A1 METHOD FOR PRODUCING ALCOHOL COMPOUND AND CATALYST THEREFOR ADH1A, ADH1C, ADH5 ALDH1A1 33/4885TSHR 2411/4885GRIN2D 4086/4885
US-20110042227-A1 Ruthenium or Osmium Complexes and Their Uses as Catalysts for Water Oxidation PPOX, AQP1, AQP3 ALDH1A1 1209/4885TSHR 3008/4885GRIN2D 3322/4885

“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.