SCHEMBL4708030

SCHEMBL4708030

CCOC(=O)c1nn(C(OC(=O)OC(C)C)C(C)C)nc1C(=O)c1cc(OC)c(OC)cc1N

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.37
MAPT P10636 5/20 0.35
ALDH1A1 P00352 5/20 0.34
DPP4 P27487 2/20 0.34
LMNA P02545 2/20 0.34
MAPK1 P28482 2/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
GAA P10253 3/20 0.33
ADORA3 P0DMS8 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HPGD P15428 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.32
SLC5A1 P13866 1/20 0.32
SLC5A2 P31639 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
SCHEMBL5518587 0.96 MAPT (0.38) KDM4EMAPTALDH1A1DPP4LMNA
SCHEMBL5512978 0.90 KDM4E (0.34) KDM4EMAPTALDH1A1DPP4LMNA
SCHEMBL5517835 0.88 MAPT (0.35) KDM4EMAPTALDH1A1MAPK1KMT2A
SCHEMBL6093093 0.86 KDM4E (0.31) KDM4EMAPT
SCHEMBL5509238 0.85 MAPT (0.41) KDM4EMAPTALDH1A1LMNAKMT2A
SCHEMBL6095019 0.85 ALDH1A1 (0.33) MAPTALDH1A1MAPK1
SCHEMBL5516128 0.85 MAPT (0.43) KDM4EMAPTALDH1A1LMNAMAPK1
SCHEMBL5508711 0.85 KDM4E (0.38) KDM4EMAPTALDH1A1DPP4LMNA
SCHEMBL5509867 0.83 KDM4E (0.40) KDM4EMAPTALDH1A1DPP4LMNA
SCHEMBL5512817 0.83 KDM4E (0.42) KDM4EMAPTALDH1A1DPP4LMNA

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1469000-B1 NOVEL CRYSTALLINE TRICYCLIC TRIAZOLOBENZAZEPINE DERIVATIVE MEIJI SEIKA KAISHA (JP) 2008-10-08 EP disclosed
US-7238812-B2 Tricyclic triazolobenzazepine derivatives, process for producing the same, and antiallergic agents MEJI SEIKA KAISHA, LTD. (JP) 2007-07-03 US disclosed
US-20060074074-A1 Tricyclic triazolobenzazepine derivatives, process for producing the same, and antiallergic agents MEIJI SEIKA PHARMA CO., LTD. (JP) 2006-04-06 US disclosed
US-7022860-B2 Tricyclic triazolobenzazepine derivatives, process for producing the same, and antiallergic agents MEIJI SEIKA KAISHA, LTD. (JP) 2006-04-04 US disclosed
US-7002009-B2 Crystalline tricyclic triazolobenzazepine derivative MEIJI SEIKA KAISHA, LTD. (JP) 2006-02-21 US disclosed
US-20050020579-A1 Novel crystalline tricyclic triazolobenzazepine derivative MEIJI SEIKA PHARMA CO., LTD. (JP) 2005-01-27 US disclosed
EP-1469000-A1 NOVEL CRYSTALLINE TRICYCLIC TRIAZOLOBENZAZEPINE DERIVATIVE MEIJI SEIKA KAISHA LTD. (JP) 2004-10-20 EP disclosed
EP-1026167-B1 TRICYCLIC TRIAZOLOBENZAZEPINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND ANTIALLERGIC AGENTS MEIJI SEIKA KAISHA (JP) 2003-03-05 EP disclosed
US-20020137739-A1 Tricyclic triazolobenzazepine derivatives, process for producing the same, and antiallergic agents MEIJI SEIKA PHARMA CO., LTD. (JP) 2002-09-26 US disclosed
US-6372735-B1 ANTIHISTAMINES MEIJI SEIKA KAISHA, LTD. (JP) 2002-04-16 US disclosed
EP-1026167-A1 TRICYCLIC TRIAZOLOBENZAZEPINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND ANTIALLERGIC MEIJI SEIKA KAISHA LTD. (JP) 2000-08-09 EP 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-20050020579-A1 Novel crystalline tricyclic triazolobenzazepine derivative GRIN2C, HTR2C, HTR2B KDM4E 873/4885MAPT 354/4885ALDH1A1 1411/4885
US-20060074074-A1 Tricyclic triazolobenzazepine derivatives, process for producing the same, and antiallergic agents HRH4, CYP2D6, CYP2B6 KDM4E 752/4885MAPT 3031/4885ALDH1A1 959/4885
US-20020137739-A1 Tricyclic triazolobenzazepine derivatives, process for producing the same, and antiallergic agents HRH4, CYP3A4, TPH1 KDM4E 547/4885MAPT 3223/4885ALDH1A1 691/4885

“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.