SCHEMBL7526207

SCHEMBL7526207

CCOC(=O)c1ccc(NC(=O)CCN2CNc3c2nc(N)[nH]c3=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.48
GAA P10253 2/20 0.48
ALDH1A1 P00352 4/20 0.47
NAMPT P43490 1/20 0.46
HPRT1 P00492 2/20 0.46
MAPT P10636 8/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
USP2 O75604 2/20 0.45
POLB P06746 2/20 0.45
HPGD P15428 2/20 0.45
HSD17B10 Q99714 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
ESR1 P03372 1/20 0.45
RECQL P46063 1/20 0.45
MCL1 Q07820 1/20 0.45
BAP1 Q92560 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.45
TP53 P04637 1/20 0.44
LMNA P02545 2/20 0.43

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
SCHEMBL5258342 0.87 HPRT1 (0.48) ALDH1A1HPRT1MEN1KMT2APOLB
Hydrochloric Acid SCHEMBL7571975 0.81 HDAC3 (0.48) THRBALDH1A1NAMPTHPRT1MAPT
SCHEMBL7567089 0.77 HPRT1 (0.54) HPRT1USP2HSD17B10CASP7
SCHEMBL7570471 0.77 HPRT1 (0.48) GAAALDH1A1HPRT1MAPTMEN1
SCHEMBL7570108 0.74 HPRT1 (0.42) ALDH1A1HPRT1POLB
SCHEMBL7982326 0.73 HPRT1 (0.51) GAAALDH1A1HPRT1MAPTKDM4E
SCHEMBL7570074 0.72 HPRT1 (0.53) GAAALDH1A1HPRT1KMT2AHPGD
SCHEMBL7570874 0.71 HPRT1 (0.45) THRBALDH1A1HPRT1MAPTPOLB
SCHEMBL7570941 0.71 HPRT1 (0.49) HPRT1
SCHEMBL7576799 0.71 HPRT1 (0.51) HPRT1MEN1KMT2ALMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020128264-A1 Methods for treatment of conditions affected by activity of multidrug transporters NEOTHERAPEUTICS, INC. 2002-09-12 US claimed
US-20020040032-A1 Methods for stimulation of synthesis of synaptophysin in the central nervous system NEOTHERAPEUTICS, INC. 2002-04-04 US claimed
EP-1237890-A1 SYNTHESIS AND METHODS OF USE OF 9-SUBSTITUTED GUANINE DERIVATIVES Neotherapeutics, Inc. (US) 2002-09-11 EP disclosed
WO-2001029039-A1 SYNTHESIS AND METHODS OF USE OF 9-SUBSTITUTED GUANINE DERIVATIVES 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 (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-20020040032-A1 Methods for stimulation of synthesis of synaptophysin in the central nervous system GAP43, BDNF, APP THRB 3032/4885GAA 416/4885ALDH1A1 2867/4885
US-20020128264-A1 Methods for treatment of conditions affected by activity of multidrug transporters SLC29A1, ABCB1, NUDT1 THRB 3527/4885GAA 1184/4885ALDH1A1 522/4885

“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.