SCHEMBL930873

SCHEMBL930873

O=C(CCN1CNc2c1nc[nH]c2=O)Nc1ccc(C(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 1/20 0.47
MEN1 O00255 7/20 0.38
KMT2A Q03164 7/20 0.38
POLB P06746 6/20 0.37
TDP1 Q9NUW8 5/20 0.37
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CTDSP1 Q9GZU7 4/20 0.37
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
BLM P54132 2/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPC1 O15118 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
Water SCHEMBL6931313 0.99 HPRT1 (0.46) HPRT1MEN1KMT2APOLBTDP1
Hydrochloric Acid SCHEMBL6935179 0.99 HPRT1 (0.46) HPRT1MEN1KMT2APOLBTDP1
Potassium Ion SCHEMBL6932912 0.90 HPRT1 (0.45) HPRT1MEN1KMT2APOLBALDH1A1
SCHEMBL7684221 0.82 HPRT1 (0.45) HPRT1KMT2ACYP2C9SMN1; SMN2NPC1
SCHEMBL6936403 0.78 HPRT1 (0.44) HPRT1MEN1KMT2ATDP1ALDH1A1
SCHEMBL1248604 0.77 HPRT1 (0.37) HPRT1MEN1KMT2APOLBTDP1
Acetic Acid SCHEMBL6932552 0.77 HPRT1 (0.43) HPRT1MEN1KMT2ALMNA
Leteprinim SCHEMBL358491 0.72 HPRT1 (0.50) HPRT1LMNA
SCHEMBL8768185 0.72 HPRT1 (0.54) HPRT1KMT2APOLBTDP1ALDH1A1
Leteprinim SCHEMBL6931317 0.72 HPRT1 (0.49) HPRT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1294722-B1 METHODS OF SYNTHESIS FOR 9-SUBSTITUTED HYPOXANTHINE DERIVATIVES MERCK EPROVA AG (CH) 2007-08-01 EP claimed
US-20050014943-A1 Methods of synthesis for 9-substituted hypoxanthine derivatives NEOTHERAPEUTICS, INC. 2005-01-20 US claimed
EP-1368350-A1 NOVEL CRYSTAL FORMS OF 9-SUBSTITUTED HYPOXANTHINE DERIVATIVES Neotherapeutics, Inc. (US) 2003-12-10 EP claimed
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 claimed
EP-1294722-A2 METHODS OF SYNTHESIS FOR 9-SUBSTITUTED HYPOXANTHINE DERIVATIVES Neotherapeutics, Inc. (US) 2003-03-26 EP claimed
WO-2003011863-A1 NOVEL CRYSTAL FORMS OF 9-SUBSTITUTED HYPOXANTHINE DERIVATIVES NEOTHERAPEUTICS, INC. (US) 2003-02-13 WO claimed
US-20020128264-A1 Methods for treatment of conditions affected by activity of multidrug transporters NEOTHERAPEUTICS, INC. 2002-09-12 US claimed
WO-2001028545-A9 USE OF CARBON MONOXIDE DEPENDENT GUANYLYL CYCLASE MODIFIERS TO STIMULATE NEURITOGENESIS NEOTHERAPEUTICS INC (US) 2002-08-15 WO claimed
EP-1230242-A1 USE OF 9-SUBSTITUTED HYPOXANTHINE DERIVATIVES TO STIMULATE REGENERATION OF NERVOUS TISSUE Neotherapeutics, Inc. (US) 2002-08-14 EP claimed
WO-2001036419-A9 USE OF 9-SUBSTITUTED HYPOXANTHINE DERIVATIVES TO STIMULATE REGENERATION OF NERVOUS TISSUE NEOTHERAPEUTICS INC (US) 2002-08-08 WO claimed
EP-1225877-A2 USE OF CARBON MONOXIDE DEPENDENT GUANYLYL CYCLASE MODIFIERS TO STIMULATE NEURITOGENESIS Neotherapeutics, Inc. (US) 2002-07-31 EP claimed
US-6407237-B1 SALT FORMATION WITH POTASSIUM HYDROXIDE; PRECIPITATION INETHANOL; CRYSTALLIZATION NEOTHERAPEUTICS, INC. 2002-06-18 US claimed
WO-2002004449-A2 METHODS FOR TREATMENT OF CONDITIONS AFFECTED BY ACTIVITY OF MULTIDRUG TRANSPORTERS NEOTHERAPEUTICS, INC. (US) 2002-01-17 WO claimed
US-6338963-B1 GENE EXPRESSION OF MOLECULES IN MAMMALS NEOTHERAPEUTICS, INC. 2002-01-15 US claimed
WO-2002000659-A2 METHODS OF SYNTHESIS FOR 9-SUBSTITUTED HYPOXANTHINE DERIVATIVES NEOTHERAPEUTICS, INC. (US) 2002-01-03 WO claimed
WO-2001036419-A1 USE OF 9-SUBSTITUTED HYPOXANTHINE DERIVATIVES TO STIMULATE REGENERATION OF NERVOUS TISSUE NEOTHERAPEUTICS, INC. (US) 2001-05-25 WO claimed
WO-2001028545-A2 USE OF CARBON MONOXIDE DEPENDENT GUANYLYL CYCLASE MODIFIERS TO STIMULATE NEURITOGENESIS NEOTHERAPEUTICS, INC. (US) 2001-04-26 WO claimed
EP-1790344-B1 Methods for treatment of disease-induced peripheral neuropathy and related conditions SPECTRUM PHARMACEUTICALS INC (US) 2011-02-23 EP disclosed
WO-2001029039-A1 SYNTHESIS AND METHODS OF USE OF 9-SUBSTITUTED GUANINE DERIVATIVES NEOTHERAPEUTICS, INC. (US) 2001-04-26 WO disclosed
WO-2001028545-A2 USE OF CARBON MONOXIDE DEPENDENT GUANYLYL CYCLASE MODIFIERS TO STIMULATE NEURITOGENESIS NEOTHERAPEUTICS, INC. (US) 2001-04-26 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 (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-20020128264-A1 Methods for treatment of conditions affected by activity of multidrug transporters SLC29A1, ABCB1, NUDT1 HPRT1 8/4885MEN1 4715/4885KMT2A 4036/4885

“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.