SCHEMBL2820307

SCHEMBL2820307

CC(C)c1cccc(C(C)C)c1N1C(=O)c2ccc([N+](=O)[O-])cc2C1=O

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 3/20 0.63
DPP4 P27487 3/20 0.63
NR1H2 P55055 1/20 0.51
NR1H3 Q13133 1/20 0.51
CA12 O43570 4/20 0.51
CA9 Q16790 3/20 0.51
CA1 P00915 2/20 0.51
CA2 P00918 2/20 0.51
ALDH1A1 P00352 2/20 0.49
SCN2A Q99250 2/20 0.49
MAPT P10636 1/20 0.47
PTPRC P08575 2/20 0.47
ACHE P22303 2/20 0.47
BCHE P06276 1/20 0.47
CES1 P23141 1/20 0.47
S100A4 P26447 1/20 0.47

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
SCHEMBL9812679 0.80 ANPEP (0.62) ANPEPDPP4CA12CA9CA1
SCHEMBL13171786 0.79 ANPEP (0.71) ANPEPDPP4NR1H2NR1H3CA12
SCHEMBL2820118 0.77 DPP4 (0.78) ANPEPDPP4NR1H2NR1H3
SCHEMBL29366407 0.77 DPP4 (0.78) ANPEPDPP4NR1H2NR1H3
SCHEMBL9812636 0.77 ANPEP (0.69) ANPEPDPP4NR1H2NR1H3
SCHEMBL2818285 0.77 ANPEP (1.00) ANPEPDPP4NR1H2NR1H3ALDH1A1
SCHEMBL173289 0.77 ANPEP (1.00) ANPEPDPP4NR1H2NR1H3
SCHEMBL9468420 0.77 SCN2A (0.74) CA12CA9CA1CA2ALDH1A1
SCHEMBL1468419 0.77 CA12 (0.64) CA12CA9CA1CA2ALDH1A1
SCHEMBL9807445 0.76 CA12 (0.53) ANPEPDPP4NR1H2NR1H3CA12

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
US-20100247659-A1 PHENYLPHTHALIMIDE ANALOGS FOR TREATING DIABETIC MACULAR EDEMA CHARLESSON, LLC (US) 2010-09-30 US claimed
JP-10072346-A None JP disclosed
US-20100247659-A1 PHENYLPHTHALIMIDE ANALOGS FOR TREATING DIABETIC MACULAR EDEMA CHARLESSON, LLC (US) 2010-09-30 US disclosed
US-20100247659-A1 PHENYLPHTHALIMIDE ANALOGS FOR TREATING DIABETIC MACULAR EDEMA CHARLESSON, LLC (US) 2010-09-30 US disclosed
US-20100247659-A1 PHENYLPHTHALIMIDE ANALOGS FOR TREATING DIABETIC MACULAR EDEMA CHARLESSON, LLC (US) 2010-09-30 US disclosed
US-6515129-B1 A pharmaceutical composition which comprises, a cyclic imide derivative represented by the general formula (I): present invention relates to an aminopeptidase N inhibitor or an angiogenesis inhibitor, modulates production of tumor necrosis ISHIHARA SANGYO KAISHA LTD. (JP) 2003-02-04 US disclosed
US-6429212-B1 AMINOPEPTIDASE N INHIBITOR USED TO TREAT CANCER, TUMORS, AND RETINOPATHY; FEW SIDE EFFECTS; ANGIOGENESIS INHIBITOR ISHIHARA SANGYO KAISHA LTD. (JP) 2002-08-06 US disclosed
JP-H1072346-A TUMOR NECROSIS FACTOR PRODUCTION-INHIBITING MEDICINE OR VASCULARIZATION-INHIBITING MEDICINE CONTAINING N-PHENYLPHTHALIMIDE DERIVATIVE ISHIHARA SANGYO KAISHA LTD 1998-03-17 JP disclosed
EP-0245989-B1 FLUOROPHTHALIMIDES MEIJI SEIKA KABUSHIKI KAISHA (JP) 1991-07-10 EP disclosed
US-4839378-A FOR CONTROLLING PLANT DISEASES MEIJI SEIKA KABUSHIKI KAISHA (JP) 1989-06-13 US disclosed
EP-0245989-A2 Fluorophthalimides MEIJI SEIKA KABUSHIKI KAISHA (JP) 1987-11-19 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 (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-20100247659-A1 PHENYLPHTHALIMIDE ANALOGS FOR TREATING DIABETIC MACULAR EDEMA SLC2A8, VEGFA, SLC2A1 ANPEP 363/4885DPP4 35/4885NR1H2 4642/4885

“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.