SCHEMBL218016

SCHEMBL218016

NC(=O)c1[nH]c(C2O[C@H](CO)[C@@H](O)[C@H]2O)nc1N

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
UMPS P11172 1/20 0.54
KDM4E B2RXH2 2/20 0.47
MAPT P10636 2/20 0.47
GMNN O75496 1/20 0.47
LMNA P02545 1/20 0.47
BLM P54132 1/20 0.47
PMP22 Q01453 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
TSHR P16473 1/20 0.47
NFKB1 P19838 1/20 0.47
STAT6 P42226 1/20 0.47
HIF1A Q16665 1/20 0.47
PYGL P06737 7/20 0.42
TDP1 Q9NUW8 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL7893929 0.86 UMPS (0.54) UMPSKDM4EMAPTGMNNLMNA
SCHEMBL164884 0.81 UMPS (0.48) UMPSKDM4EMAPTGMNNLMNA
SCHEMBL6934749 0.81 UMPS (0.48) UMPSKDM4EMAPTGMNNLMNA
SCHEMBL20581714 0.76 LMNA (0.50) UMPSKDM4EMAPTGMNNLMNA
SCHEMBL30573140 0.76 UMPS (0.48) UMPSKDM4EMAPTGMNNLMNA
SCHEMBL1980709 0.74 UMPS (0.44) UMPSKDM4EMAPTGMNNLMNA
SCHEMBL27596793 0.74 UMPS (0.44) UMPSKDM4EMAPTGMNNLMNA
SCHEMBL22672223 0.74 UMPS (0.55) UMPSPYGL
SCHEMBL3394996 0.74 UMPS (0.55) UMPSPYGL
SCHEMBL2481560 0.74 UMPS (0.49) UMPSKDM4EMAPTGMNNLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088752-B2 Methods for metabolic modulation VDF FUTURECEUTICALS, INC. (US) 2012-01-03 US disclosed
US-20090203638-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR METABOLIC MODULATION VDF FUTURECEUTICALS, INC. (US) 2009-08-13 US disclosed
US-20070161582-A1 Pharmaceutical compositions and methods for metabolic modulation VDF FUTURECEUTICALS 2007-07-12 US disclosed
WO-2005020892-A2 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR METABOLIC MODULATION MITOCHROMA RESEARCH, INC. (US) 2005-03-10 WO disclosed
US-4900407-A Method for deoxygenation of alcohols YAMASA SHOYU KABUSHIKI KAISHA (JP) 1990-02-13 US disclosed
EP-0238672-A1 PROCESS FOR DEOXIDIZING ALCOHOL Yamasa Shoyu Kabushiki Kaisha (JP) 1987-09-30 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 (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-20070161582-A1 Pharmaceutical compositions and methods for metabolic modulation GPR119, PRKAG2, PRKAG1 UMPS 239/4885KDM4E 4093/4885MAPT 4052/4885
US-20090203638-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR METABOLIC MODULATION GPR119, PRKAG2, GCKR UMPS 226/4885KDM4E 4031/4885MAPT 3944/4885

“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.