SCHEMBL931907

SCHEMBL931907

O=C(CCN1CNc2c1nc[nH]c2=O)NCCc1ccc(O)c(O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
TRPV1 Q8NER1 4/20 0.43
HSD17B10 Q99714 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
HPRT1 P00492 1/20 0.43
ERCC1 P07992 1/20 0.41
ERCC4 Q92889 1/20 0.41
ALOX12 P18054 3/20 0.41
HPGD P15428 3/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 2/20 0.40
BLM P54132 2/20 0.40
HIF1A Q16665 2/20 0.40
ALDH1A1 P00352 2/20 0.40
NPC1 O15118 1/20 0.40
GMNN O75496 1/20 0.40
USP2 O75604 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40

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
SCHEMBL7571677 0.83 HPRT1 (0.44) MAPTTRPV1HSD17B10MEN1KMT2A
SCHEMBL931453 0.79 MEN1 (0.53) MAPTMEN1KMT2ALMNABLM
SCHEMBL931472 0.79 TRPV1 (0.52) MAPTTRPV1HPGDKDM4EBLM
SCHEMBL7376553 0.75 HPRT1 (0.47) MAPTTRPV1HSD17B10MEN1KMT2A
SCHEMBL7375871 0.73 HPRT1 (0.58) MAPTHSD17B10MEN1KMT2AHPRT1
SCHEMBL930873 0.71 HPRT1 (0.47) MAPTHSD17B10MEN1KMT2AHPRT1
Water SCHEMBL6931313 0.71 HPRT1 (0.46) MAPTHSD17B10MEN1KMT2AHPRT1
SCHEMBL109158 0.70 MAPT (0.73) MAPTTRPV1HSD17B10MEN1KMT2A
SCHEMBL7684221 0.70 HPRT1 (0.45) KMT2AHPRT1KDM4ENPC1CYP2C9
SCHEMBL7570897 0.70 CA1 (0.50) HSD17B10HPRT1ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999057119-A1 NOVEL DOPAMINE-LIKE 9-SUBSTITUTED HYPOXANTHINE AND METHODS OF USE NEOTHERAPEUTICS, INC. (US) 1999-11-11 WO claimed
WO-1999056550-A1 METHOD FOR TREATING MIGRAINE IN MAMMALS NEOTHERAPEUTICS, INC. (US) 1999-11-11 WO claimed
EP-1334103-B1 METHODS FOR TREATMENT OF DISEASE-INDUCED PERIPHERAL NEUROPATHY AND RELATED CONDITIONS SPECTRUM PHARMACEUTICALS INC (US) 2011-01-12 EP disclosed
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
EP-1334103-A2 METHODS FOR TREATMENT OF DISEASE-INDUCED PERIPHERAL NEUROPATHY AND RELATED CONDITIONS Neotherapeutics, Inc. (US) 2003-08-13 EP disclosed
EP-1334104-A2 METHODS FOR TREATMENT OF DRUG-INDUCED PERIPHERAL NEUROPATHY AND RELATED CONDITIONS Neotherapeutics, Inc. (US) 2003-08-13 EP disclosed
US-20020128264-A1 Methods for treatment of conditions affected by activity of multidrug transporters NEOTHERAPEUTICS, INC. 2002-09-12 US disclosed
WO-2002058736-A2 USE OF 9-SUBSTITUTED PURINE ANALOGUES AND OTHER MOLECULES TO STIMULATE NEUROGENESIS NEOTHERAPETICS, INC. (US) 2002-08-01 WO disclosed
US-20020091133-A1 Use of 9-substituted purine analogues and other molecules to stimulate neurogenesis EVE M. TAYLOR 2002-07-11 US 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-2002004452-A2 METHODS FOR TREATMENT OF DISEASE-INDUCED PERIPHERAL NEUROPATHY AND RELATED CONDITIONS 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
US-6303617-B1 FOR THERAPY OF OBESITY, LOWERING SERUM CHOLESTEROL AND HIGH DENSITY LIPOPROTEIN IN MAMMALS, INHIBITOR OF MONOAMINE OXIDASE NEOTHERAPEUTICS, INC. 2001-10-16 US disclosed
WO-1999057120-A9 NOVEL SEROTONIN-LIKE 9-SUBSTITUTED HYPOXANTHINE AND METHODS OF USE NEOTHERAPEUTICS INC (US) 2000-02-03 WO disclosed
WO-1999057119-A1 NOVEL DOPAMINE-LIKE 9-SUBSTITUTED HYPOXANTHINE AND METHODS OF USE NEOTHERAPEUTICS, INC. (US) 1999-11-11 WO disclosed
WO-1999057119-A1 NOVEL DOPAMINE-LIKE 9-SUBSTITUTED HYPOXANTHINE AND METHODS OF USE NEOTHERAPEUTICS, INC. (US) 1999-11-11 WO disclosed
WO-1999057120-A1 NOVEL SEROTONIN-LIKE 9-SUBSTITUTED HYPOXANTHINE AND METHODS OF USE NEOTHERAPEUTICS, INC. (US) 1999-11-11 WO disclosed
WO-1999056550-A1 METHOD FOR TREATING MIGRAINE IN MAMMALS NEOTHERAPEUTICS, INC. (US) 1999-11-11 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 (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-20020128264-A1 Methods for treatment of conditions affected by activity of multidrug transporters SLC29A1, ABCB1, NUDT1 MAPT 3440/4885TRPV1 767/4885HSD17B10 2184/4885
US-20020091133-A1 Use of 9-substituted purine analogues and other molecules to stimulate neurogenesis DCX, MKI67, TK2 MAPT 4186/4885TRPV1 370/4885HSD17B10 3461/4885

“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.