SCHEMBL5490233

SCHEMBL5490233

CCC(N1C(=O)c2ccccc2C1=O)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.52
CASP3 P42574 1/20 0.47
LMNA P02545 1/20 0.46
ALDH1A1 P00352 6/20 0.44
GAA P10253 2/20 0.44
POLB P06746 2/20 0.43
KDM4E B2RXH2 1/20 0.43
TP53 P04637 1/20 0.43
GLA P06280 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
HPGD P15428 1/20 0.43
ALOX12 P18054 1/20 0.43
NFKB1 P19838 1/20 0.43
APEX1 P27695 1/20 0.43
MAPK1 P28482 1/20 0.43
HSD17B10 Q99714 1/20 0.43
DRD3 P35462 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
HTT P42858 1/20 0.41

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
SCHEMBL3697798 0.87 TDP1 (0.45) TDP1CASP3LMNAALDH1A1GAA
SCHEMBL6659850 0.83 TDP1 (0.49) TDP1CASP3LMNAALDH1A1GAA
SCHEMBL6364898 0.83 TDP1 (0.52) TDP1CASP3LMNAALDH1A1GAA
SCHEMBL11290023 0.81 NPC1 (0.51) TDP1CASP3LMNAALDH1A1KDM4E
SCHEMBL19615470 0.81 TDP1 (0.50) TDP1CASP3LMNAALDH1A1GAA
SCHEMBL6127956 0.81 TDP1 (0.65) TDP1CASP3LMNAALDH1A1GAA
SCHEMBL6666103 0.81 TDP1 (0.50) TDP1CASP3LMNAALDH1A1GAA
SCHEMBL29459229 0.81 TDP1 (0.65) TDP1CASP3LMNAALDH1A1GAA
SCHEMBL14570441 0.81 TDP1 (0.65) TDP1CASP3LMNAALDH1A1GAA
SCHEMBL4072630 0.79 TDP1 (0.49) TDP1CASP3LMNAALDH1A1GAA

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
WO-2007127930-A2 COMPOUNDS AFFECTING GAP JUNCTION ACTIVITY KANSAS STATE UNIVERSITY RESEARCH FOUNDATION (US) 2007-11-08 WO disclosed
US-20040176612-A1 Method for preparing n-($g(v)-bromoalkyl)phthalimides GILLET JEAN-PHILIPPE (FR) 2004-09-09 US disclosed
US-20040176613-A1 Method for preparing n-($g(v)-bromoalkyl)phthalimides GILLET JEAN-PHILIPPE (FR) 2004-09-09 US disclosed
EP-1436260-A1 METHOD FOR PREPARING N-(V)-BROMOALKYL)PHTHALIMIDES Albemarle Chemicals SAS (US) 2004-07-14 EP disclosed
EP-1436261-A1 METHOD FOR PREPARING N-($G(V)-BROMOALKYL)PHTHALIMIDES Albemarle Chemicals SAS (US) 2004-07-14 EP disclosed
WO-2003027071-A1 METHOD FOR PREPARING N-($G(V)-BROMOALKYL)PHTHALIMIDES ALBEMARLE CHEMICALS SAS (US) 2003-04-03 WO disclosed
WO-2003027070-A1 METHOD FOR PREPARING N-($G(V)-BROMOALKYL)PHTHALIMIDES ALBEMARLE CHEMICALS SAS (US) 2003-04-03 WO disclosed
US-RE35631-E Method of production of essentially pure melatonin and the method of solubilizing melatonin in water IFLO S.A.S. (IT) 1997-10-14 US disclosed
EP-0330625-B1 Total synthesis method for making an indole structure derivative product class, of the triptamine type, in particular, melatonin or N-acetyl-5-methoxytriptamine type, having a high purity degree and easily soluble, for therapeutic use against acquired immuno-deficiency syndromes I F L O S A S DI GIORGIO E ALD (IT) 1995-12-20 EP disclosed
US-5122535-A Mixing with adenosine; treating AIDS IFLO S.A.S. (IT) 1992-06-16 US disclosed
EP-0330625-A2 Total synthesis method for making an indole structure derivative product class, of the triptamine type, in particular, melatonin or N-acetyl-5-methoxytriptamine type, having a high purity degree and easily soluble, for therapeutic use against acquired immuno-deficiency syndromes I.F.L.O. S.a.s. di Giorgio e Aldo Laguzzi (IT) 1989-08-30 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 (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-20040176612-A1 Method for preparing n-($g(v)-bromoalkyl)phthalimides GK, DGKA, GNG2 TDP1 3482/4885CASP3 2150/4885LMNA 536/4885
US-20040176613-A1 Method for preparing n-($g(v)-bromoalkyl)phthalimides GK, DGKG, DGKA TDP1 3495/4885CASP3 1326/4885LMNA 604/4885

“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.