SCHEMBL713073

SCHEMBL713073

O=C1c2ccccc2C(=O)c2c1ccc1nc(CN3CCC(CCCC4CCNCC4)CC3)[nH]c21

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 1/20 0.74
GRIN1 Q05586 6/20 0.39
GRIN2B Q13224 6/20 0.39
THRB P10828 1/20 0.37
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP3A5 P20815 2/20 0.36
CYP3A7 P24462 2/20 0.36
CYP2C19 P33261 2/20 0.36
PDK4 Q16654 2/20 0.36
CYP3A43 Q9HB55 2/20 0.36
DRD4 P21917 1/20 0.36
ACHE P22303 4/20 0.36
BCHE P06276 3/20 0.36
ITGB3 P05106 2/20 0.35
ITGA2B P08514 2/20 0.35
MAPT P10636 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL714240 0.84 TERT (0.51) TERTGRIN1GRIN2BTHRBDRD4
SCHEMBL713735 0.81 HTT (0.52) TERTMAPTNPSR1L3MBTL1
SCHEMBL713856 0.81 HTT (0.52) TERTMAPTNPSR1L3MBTL1
SCHEMBL712820 0.79 TERT (0.45) TERTDRD4BCHEMAPTNPSR1
SCHEMBL710529 0.79 ADORA2A (0.45) TERTMAPTNPSR1TDP1L3MBTL1
SCHEMBL719983 0.79 L3MBTL1 (0.54) TERTGRIN1GRIN2BDRD4MAPT
SCHEMBL716624 0.79 GAA (0.47) TERTDRD4MAPTNPSR1TDP1
SCHEMBL713005 0.79 HPGD (0.54) TERTMAPTNPSR1TDP1L3MBTL1
SCHEMBL719451 0.77 DRD4 (0.56) TERTDRD4MAPTNPSR1TDP1
SCHEMBL713553 0.76 TERT (0.43) TERTCYP1A2CYP2C19DRD4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124637-B2 Anthra [1, 2-d]imidazole-6,11-dione derivatives, preparation method and application thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2012-02-28 US claimed
US-8124637-B2 Anthra [1, 2-d]imidazole-6,11-dione derivatives, preparation method and application thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2012-02-28 US disclosed
US-8124637-B2 Anthra [1, 2-d]imidazole-6,11-dione derivatives, preparation method and application thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2012-02-28 US disclosed
US-8124637-B2 Anthra [1, 2-d]imidazole-6,11-dione derivatives, preparation method and application thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2012-02-28 US disclosed
US-20110207719-A1 Novel Anthra [1, 2-d]imidazole-6,11-dione Derivatives, Preparation Method and application thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2011-08-25 US disclosed
US-20110207719-A1 Novel Anthra [1, 2-d]imidazole-6,11-dione Derivatives, Preparation Method and application thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2011-08-25 US disclosed
US-20110207719-A1 Novel Anthra [1, 2-d]imidazole-6,11-dione Derivatives, Preparation Method and application thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2011-08-25 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 (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-20110207719-A1 Novel Anthra [1, 2-d]imidazole-6,11-dione Derivatives, Preparation Method and application thereof TERT, ACIN1, AK2 TERT 1/4885GRIN1 4753/4885GRIN2B 4828/4885

“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.