SCHEMBL1709871

SCHEMBL1709871

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nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.37
GRIK2 Q13002 2/20 0.37
ECE1 P42892 1/20 0.31
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL17920045 1.00 GRIK1 (0.37) GRIK1GRIK2ECE1ALDH1A1MAPT
SCHEMBL15909791 1.00 GRIK1 (0.37) GRIK1GRIK2ECE1ALDH1A1MAPT
SCHEMBL13540707 1.00 GRIK1 (0.37) GRIK1GRIK2ECE1ALDH1A1MAPT
SCHEMBL14852861 1.00 GRIK1 (0.37) GRIK1GRIK2ECE1ALDH1A1MAPT
SCHEMBL19984497 0.84 GRIK1 (0.39) GRIK1GRIK2ECE1
SCHEMBL13447538 0.84 GRIK1 (0.39) GRIK1GRIK2ECE1
SCHEMBL3966053 0.82 GRIK1 (0.38) GRIK1GRIK2MAPT
SCHEMBL3966055 0.82 GRIK1 (0.38) GRIK1GRIK2MAPT
SCHEMBL17524625 0.81 GABRR1 (0.38) ALDH1A1MAPT
SCHEMBL17087511 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230041197-A1 TREATMENT OF A DISEASE OF THE GASTROINTESTINAL TRACT WITH AN IMMUNOMODULATOR GLAS USA LLC 2023-02-09 US disclosed
US-10738084-B2 Macrocycles SENTRY THERAPEUTICS LIMITED (GB) 2020-08-11 US disclosed
US-20200171122-A1 CYCLOSPORIN ANALOGUES AND USES THEREOF DYNEQ MEDICAL LIMITED (GB) 2020-06-04 US disclosed
US-10471058-B2 Pharmaceutical formulations and their use in the treatment of periodontal disease PERIOC LTD (GB) 2019-11-12 US disclosed
US-20180186836-A1 NOVEL MACROCYCLES Cypra;os Limited (GB) 2018-07-05 US disclosed
US-20180153958-A1 CYCLIC DEPSIPEPTIDE COMPOUNDS AND THEIR USES CYPRALIS LIMITED (GB) 2018-06-07 US disclosed
US-20180094031-A1 CYCLOSPORIN DERIVATIVES WHEREIN THE MEBMT SIDECHAIN HAS BEEN CYCLIZED ALLERGAN, INC. 2018-04-05 US disclosed
US-9914755-B2 Cyclosporin derivatives wherein the MeBmt sidechain has been cyclized ALLERGAN, INC. (US) 2018-03-13 US disclosed
US-9895412-B2 Cyclic depsipeptide compounds and their uses CYPRALIS LIMITED (GB) 2018-02-20 US disclosed
EP-2855508-B1 CYCLOSPORIN A ANALOGS ALLERGAN INC (US) 2018-02-14 EP disclosed
US-7696165-B2 Use of cyclosporin alkyne analogues for preventing or treating viral-induced disorders ALBANY MOLECULAR RESEARCH, INC. (US) 2010-04-13 US disclosed
US-7696166-B2 Use of cyclosporin alkyne/alkene analogues for preventing or treating viral-induced disorders ALBANY MOLECULAR RESEARCH, INC. (US) 2010-04-13 US disclosed
US-20100009953-A1 CYCLOSPORIN DERIVATIVES FOR TREATING OCULAR AND DERMAL DISEASES AND CONDITIONS ALLERGAN, INC. (US) 2010-01-14 US disclosed
US-7632807-B2 Cyclosporin alkynes and their utility as pharmaceutical agents ALBANY MOLECULAR RESEARCH, INC. (US) 2009-12-15 US disclosed
US-7538084-B2 Cyclosporins AMR TECHNOLOGY, INC. (US) 2009-05-26 US disclosed
US-7511013-B2 Cyclosporin analogues and their pharmaceutical uses AMR TECHNOLOGY, INC. (US) 2009-03-31 US disclosed
US-20080249002-A1 CYCLOSPORIN ALKYNE ANALOGUES AND THEIR PHARMACEUTICAL USES AMR TECHNOLOGY, INC. (US) 2008-10-09 US disclosed
US-20080153744-A1 NOVEL CYCLOSPORIN ALKYNES AND THEIR UTILITY AS PHARMACEUTICAL AGENTS AMR TECHNOLOGY, INC. (US) 2008-06-26 US disclosed
US-7361636-B2 Cyclosporin alkynes and their utility as pharmaceutical agents AMR TECHNOLOGY, INC. (US) 2008-04-22 US disclosed
US-7196161-B2 3-ether and 3-thioether substituted cyclosporin derivatives for the treatment and prevention of hepatitis C infection SCYNEXIS INC. (US) 2007-03-27 US 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 (10 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-20100009953-A1 CYCLOSPORIN DERIVATIVES FOR TREATING OCULAR AND DERMAL DISEASES AND CONDITIONS HRH4, HCAR3, NR1H4 GRIK1 3311/4885GRIK2 3289/4885ECE1 406/4885
US-20180094031-A1 CYCLOSPORIN DERIVATIVES WHEREIN THE MEBMT SIDECHAIN HAS BEEN CYCLIZED CHP1, PPIB, FKBP1B GRIK1 3920/4885GRIK2 3954/4885ECE1 1824/4885
US-20080153744-A1 NOVEL CYCLOSPORIN ALKYNES AND THEIR UTILITY AS PHARMACEUTICAL AGENTS CHP1, PPP3R1, CX3CR1 GRIK1 4170/4885GRIK2 4708/4885ECE1 1228/4885
US-20230041197-A1 TREATMENT OF A DISEASE OF THE GASTROINTESTINAL TRACT WITH AN IMMUNOMODULATOR FABP2, IL2, TSLP GRIK1 4048/4885GRIK2 3140/4885ECE1 4102/4885
US-20180153958-A1 CYCLIC DEPSIPEPTIDE COMPOUNDS AND THEIR USES FKBP14, FKBP1A, PIN1 GRIK1 4431/4885GRIK2 4506/4885ECE1 487/4885
US-20200171122-A1 CYCLOSPORIN ANALOGUES AND USES THEREOF CHP1, C1S, C5 GRIK1 4214/4885GRIK2 4487/4885ECE1 1326/4885
US-10738084-B2 Macrocycles MC2R, C1R, CCNI GRIK1 3482/4885GRIK2 3834/4885ECE1 809/4885
US-20080249002-A1 CYCLOSPORIN ALKYNE ANALOGUES AND THEIR PHARMACEUTICAL USES PPP3R1, CCR7, CHP1 GRIK1 4237/4885GRIK2 4555/4885ECE1 1062/4885
US-10471058-B2 Pharmaceutical formulations and their use in the treatment of periodontal disease PPIG, PPIH, PPIL1 GRIK1 4041/4885GRIK2 3860/4885ECE1 1035/4885
US-20180186836-A1 NOVEL MACROCYCLES MC2R, CCNI, CCNE1 GRIK1 3210/4885GRIK2 3643/4885ECE1 910/4885

“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.