SCHEMBL721569

SCHEMBL721569

CC(C)C(NP(=O)(Cl)Oc1cccc2ccccc12)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 2/20 0.43
ALDH1A1 P00352 5/20 0.42
HSD17B10 Q99714 3/20 0.42
MAPK1 P28482 2/20 0.42
PGR P06401 1/20 0.42
GAA P10253 1/20 0.42
PTGS1 P23219 1/20 0.42
EGLN1 Q9GZT9 2/20 0.41
KDM4E B2RXH2 2/20 0.41
KMT2A Q03164 1/20 0.40
HPGD P15428 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MBTPS1 Q14703 1/20 0.39
OGG1 O15527 1/20 0.39
CYP2D6 P10635 4/20 0.39
CYP1A2 P05177 3/20 0.39
ADRB2 P07550 3/20 0.39
ADRB1 P08588 3/20 0.39
SLC6A4 P31645 3/20 0.39
HTR2B P41595 3/20 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
SCHEMBL721386 0.89 TACR3 (0.42) CASP3ALDH1A1HSD17B10MAPK1PGR
SCHEMBL721679 0.89 TACR3 (0.42) CASP3ALDH1A1HSD17B10MAPK1PGR
SCHEMBL720399 0.88 MME (0.41) CASP3ALDH1A1HSD17B10MAPK1PGR
SCHEMBL719597 0.87 ALDH1A1 (0.43) CASP3ALDH1A1HSD17B10MAPK1PGR
SCHEMBL1273621 0.87 ALDH1A1 (0.43) CASP3ALDH1A1HSD17B10MAPK1PGR
SCHEMBL10208224 0.85 ELANE (0.41) CASP3ALDH1A1GAAKDM4EKMT2A
SCHEMBL20305851 0.85 ELANE (0.41) CASP3ALDH1A1GAAKDM4EKMT2A
SCHEMBL721567 0.85 KMT2A (0.40) CASP3ALDH1A1HSD17B10MAPK1PGR
SCHEMBL10208250 0.84 CASP3 (0.40) CASP3ALDH1A1HSD17B10MAPK1PGR
SCHEMBL719705 0.83 EGLN1 (0.36) CASP3ALDH1A1HSD17B10EGLN1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8759318-B2 Phosphoramidate derivatives of guanosine nucleoside compounds for treatment of viral infections INHIBITEX, INC. (US) 2014-06-24 US disclosed
US-20120052046-A1 Phosphoramidate Derivatives of Guanosine Nucleoside Compunds for Treatment of Viral Infections UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2012-03-01 US disclosed
EP-2385951-A2 PHOSPHORAMIDATE DERIVATIVES OF GUANOSINE NUCLEOSIDE COMPOUNDS FOR TREATMENT OF VIRAL INFECTIONS University College Cardiff Consultants, Ltd. (GB) 2011-11-16 EP disclosed
US-20110254856-A1 MOBILE TERMINAL AND METHOD OF CONTROLLING OPERATION OF THE MOBILE TERMINAL LG ELECTRONICS INC. (KR) 2011-10-20 US disclosed
WO-2010081082-A2 PHOSPHORAMIDATE DERIVATIVES OF GUANOSINE NUCLEOSIDE COMPOUNDS FOR TREATMENT OF VIRAL INFECTIONS UNIVERSITY COLLEGE OF CARDIFF CONSULTANTS LIMITED (GB) 2010-07-15 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-20120052046-A1 Phosphoramidate Derivatives of Guanosine Nucleoside Compunds for Treatment of Viral Infections PNP, SAMHD1, MTAP CASP3 2736/4885ALDH1A1 4139/4885HSD17B10 4596/4885

“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.