SCHEMBL5250419

SCHEMBL5250419

CCOC(=O)c1ccc(NC(=O)CCn2cnc3c(=O)[nH]c(=O)[nH]c32)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.54
MAPT P10636 9/20 0.53
POLB P06746 4/20 0.53
L3MBTL1 Q9Y468 4/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
USP2 O75604 2/20 0.53
HPGD P15428 2/20 0.53
HSD17B10 Q99714 2/20 0.53
ALDH1A1 P00352 2/20 0.53
KDM4E B2RXH2 1/20 0.53
LMNA P02545 1/20 0.53
CASP1 P29466 1/20 0.53
BRCA1 P38398 1/20 0.53
HTT P42858 1/20 0.53
CASP7 P55210 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
THRB P10828 2/20 0.52
RAB9A P51151 3/20 0.48
NPC1 O15118 1/20 0.48

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
SCHEMBL1247298 0.81 GAA (0.54) GAAMAPTPOLBL3MBTL1MEN1
SCHEMBL24846633 0.80 ENPP1 (0.54) MAPTPOLBMEN1KMT2ALMNA
SCHEMBL5255525 0.78 GAA (0.56) GAAMAPTPOLBMEN1KMT2A
SCHEMBL5252681 0.76 GAA (0.53) GAAMAPTPOLBALDH1A1LMNA
SCHEMBL27503022 0.76 GAA (0.55) GAAMAPTHPGDALDH1A1THRB
SCHEMBL5251452 0.75 GAA (0.54) GAAMAPTHPGDALDH1A1LMNA
SCHEMBL7551623 0.75 GAA (0.54) GAAMAPTPOLBL3MBTL1MEN1
SCHEMBL5252873 0.75 GAA (0.52) GAAMAPTPOLBALDH1A1LMNA
SCHEMBL5250036 0.74 GAA (0.53) GAAMAPTPOLBL3MBTL1MEN1
SCHEMBL5251965 0.74 HDAC1 (0.56) GAAMAPTMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1334103-A2 METHODS FOR TREATMENT OF DISEASE-INDUCED PERIPHERAL NEUROPATHY AND RELATED CONDITIONS Neotherapeutics, Inc. (US) 2003-08-13 EP claimed
EP-1334104-A2 METHODS FOR TREATMENT OF DRUG-INDUCED PERIPHERAL NEUROPATHY AND RELATED CONDITIONS Neotherapeutics, Inc. (US) 2003-08-13 EP claimed
WO-2002085904-A1 SNYTHESIS AND METHODS OF USE OF PURINE ANALOGUES AND DERIVATIVES NEOTHERAPEUTICS, INC. (US) 2002-10-31 WO claimed
US-20020156277-A1 Synthesis and methods of use of purine analogues and derivatives NEO THERAPEUTICS, INC. 2002-10-24 US claimed
US-20020128264-A1 Methods for treatment of conditions affected by activity of multidrug transporters NEOTHERAPEUTICS, INC. 2002-09-12 US claimed
US-20020061899-A1 Methods for treatment of drug-induced peripheral neuropathy and related conditions SPECTRUM PHARMACEUTICALS, INC. 2002-05-23 US claimed
US-20020055506-A1 Methods for treatment of disease-induced peripheral neuropathy and related conditions SPECTRUM PHARMACEUTICALS, INC. 2002-05-09 US claimed
US-20020040031-A1 Methods for prevention of accumulation of amyloid beta peptide in the central nervous system NEO THERAPEUTICS, INC. 2002-04-04 US claimed
US-20020040032-A1 Methods for stimulation of synthesis of synaptophysin in the central nervous system NEOTHERAPEUTICS, INC. 2002-04-04 US claimed
WO-2002004452-A2 METHODS FOR TREATMENT OF DISEASE-INDUCED PERIPHERAL NEUROPATHY AND RELATED CONDITIONS NEOTHERAPEUTICS, INC. (US) 2002-01-17 WO claimed
WO-2002004451-A2 METHODS FOR STIMULATION OF SYNTHESIS OF SYNAPTOPHYSIN IN THE CENTRAL NERVOUS SYSTEM NEOTHERAPEUTICS, INC. (US) 2002-01-17 WO claimed
WO-2002004450-A2 METHODS FOR PREVENTION OF ACCUMULATION OF AMYLOID BETA PEPTIDE IN THE CENTRAL NERVOUS SYSTEM NEOTHERAPEUTICS, INC. (US) 2002-01-17 WO claimed
WO-2002004449-A2 METHODS FOR TREATMENT OF CONDITIONS AFFECTED BY ACTIVITY OF MULTIDRUG TRANSPORTERS NEOTHERAPEUTICS, INC. (US) 2002-01-17 WO claimed
WO-2002004448-A2 METHODS FOR TREATMENT OF DRUG-INDUCED PERIPHERAL NEUROPATHY AND RELATED CONDITIONS NEOTHERAPEUTICS, INC. (US) 2002-01-17 WO claimed
EP-1790344-A2 Methods for treatment of disease-induced peripheral neuropathy and related conditions Spectrum Pharmaceuticals, Inc. (US) 2007-05-30 EP disclosed
US-6630490-B2 Purine derivative or analogue NEOTHERAPEUTICS, INC. 2003-10-07 US disclosed
US-6630478-B2 Administering to patient with drug-induced peripheral neuropathy an effective quantity of a purine derivative or analogue, a tetrahydroindolone derivative or analogue, or a pyrimidine derivative or analogue NEOTHERAPEUTICS, INC. 2003-10-07 US disclosed
WO-2002004451-A2 METHODS FOR STIMULATION OF SYNTHESIS OF SYNAPTOPHYSIN IN THE CENTRAL NERVOUS SYSTEM NEOTHERAPEUTICS, INC. (US) 2002-01-17 WO disclosed
WO-2002004450-A2 METHODS FOR PREVENTION OF ACCUMULATION OF AMYLOID BETA PEPTIDE IN THE CENTRAL NERVOUS SYSTEM NEOTHERAPEUTICS, INC. (US) 2002-01-17 WO disclosed
WO-2002004448-A2 METHODS FOR TREATMENT OF DRUG-INDUCED PERIPHERAL NEUROPATHY AND RELATED CONDITIONS NEOTHERAPEUTICS, INC. (US) 2002-01-17 WO 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 (6 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-20020061899-A1 Methods for treatment of drug-induced peripheral neuropathy and related conditions TYMP, TYMS, NGF GAA 3182/4885MAPT 1343/4885POLB 161/4885
US-20020055506-A1 Methods for treatment of disease-induced peripheral neuropathy and related conditions NGF, NUDT1, HPRT1 GAA 2556/4885MAPT 587/4885POLB 511/4885
US-20020156277-A1 Synthesis and methods of use of purine analogues and derivatives SLC29A1, ATIC, PNP GAA 1510/4885MAPT 3325/4885POLB 755/4885
US-20020040032-A1 Methods for stimulation of synthesis of synaptophysin in the central nervous system GAP43, BDNF, APP GAA 416/4885MAPT 213/4885POLB 739/4885
US-20020128264-A1 Methods for treatment of conditions affected by activity of multidrug transporters SLC29A1, ABCB1, NUDT1 GAA 1184/4885MAPT 3440/4885POLB 773/4885
US-20020040031-A1 Methods for prevention of accumulation of amyloid beta peptide in the central nervous system APP, BACE1, SARNP GAA 363/4885MAPT 90/4885POLB 347/4885

“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.