SCHEMBL724209

SCHEMBL724209

CC(C)[C@H](NOCc1ccccc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
ADAMTS4 O75173 2/20 0.49
MMP13 P45452 1/20 0.49
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
ECE1 P42892 2/20 0.44
MME P08473 1/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
MMP2 P08253 1/20 0.43
CA9 Q16790 1/20 0.43
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43
CTSS P25774 1/20 0.43
CTSK P43235 1/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 1/20 0.42

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
SCHEMBL28581036 0.89 MME (0.49) ALDH1A1ADAMTS4MMP13NPC1RAB9A
SCHEMBL27547818 0.86 NPC1 (0.44) ALDH1A1ADAMTS4MMP13NPC1RAB9A
SCHEMBL27994897 0.83 NPC1 (0.45) ALDH1A1ADAMTS4MMP13NPC1RAB9A
SCHEMBL1012491 0.83 CA1 (0.53) ALDH1A1NPC1RAB9AMMECA1
SCHEMBL721423 0.83 CA1 (0.53) ALDH1A1NPC1RAB9AMMECA1
SCHEMBL10659989 0.83 CA1 (0.53) ALDH1A1NPC1RAB9AMMECA1
SCHEMBL3741276 0.82 NPC1 (0.41) ALDH1A1ADAMTS4MMP13NPC1RAB9A
SCHEMBL27388901 0.82 NPC1 (0.41) ALDH1A1ADAMTS4MMP13NPC1RAB9A
Hydrochloric Acid SCHEMBL857895 0.81 CA1 (0.51) ALDH1A1NPC1RAB9AMMECA1
SCHEMBL30547455 0.81 ELANE (0.44) ALDH1A1NPC1RAB9AECE1MME

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 10 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
US-6017385-A Ink compositions XEROX CORPORATION (US) 2000-01-25 US disclosed
US-5931995-A Ink compositions XEROX CORPORATION (US) 1999-08-03 US disclosed
US-5051444-A Pyrrolidine derivatives as anti-amnesia agents SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1991-09-24 US disclosed
US-4880827-A Pyrrolidine derivatives having inhibitory action for proline specific endopepidase SUMITOMO PHARMACEUTICALS COMPANY, LTD. (JP) 1989-11-14 US disclosed
EP-0238319-A1 Pyrrolidine derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1987-09-23 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 (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 ALDH1A1 4139/4885ADAMTS4 3890/4885MMP13 4555/4885

“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.