SCHEMBL1178664

SCHEMBL1178664

COc1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 1/20 0.72
▸ SLC5A1 P13866 2/20 0.64
▸ SLC5A2 P31639 2/20 0.64
▸ NPC1 O15118 2/20 0.60
▸ RAB9A P51151 2/20 0.60
▸ IL2 P60568 1/20 0.58
▸ POLB P06746 1/20 0.57

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
SCHEMBL1178662 1.00 TYR (0.72) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL1178572 1.00 TYR (0.72) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL8388035 0.98 TYR (0.75) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL16785939 0.98 TYR (0.75) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL15533442 0.98 TYR (0.75) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL4187277 0.98 TYR (0.75) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL4187272 0.98 TYR (0.75) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL7744552 0.98 TYR (0.75) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL16689576 0.98 TYR (0.75) TYRSLC5A1SLC5A2NPC1RAB9A
SCHEMBL7945567 0.98 TYR (0.75) TYRSLC5A1SLC5A2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2367837-B1 1'-SUBSTITUTED RIBOSE 5'-POLYPHOSPHATE ANALOGS AND THEIR USE AS MODULATORS OF P2Y RECEPTOR ACTIVITY MICRODOSE THERAPEUTX INC (US) 2016-08-17 — — EP disclosed
US-20160129036-A1 ADENOSINE ANALOGS AND THEIR USE MICRODOSE THERAPEUTX INC (US) 2016-05-12 — — US disclosed
US-9255121-B2 Adenosine analogs and their use MICRODOSE THERAPEUTX, INC. (US) 2016-02-09 — — US disclosed
CN-104324044-A METHODS OF MAKING NUCLEOSIDE TETRAPHOSPHATE MICRODOSE THERAPEUTX INC 2015-02-04 — — CN disclosed
US-20140038912-A1 ADENOSINE ANALOGS AND THEIR USE MICRODOSE THERAPEUTX, INC. (US) 2014-02-06 — — US disclosed
US-8569259-B2 Adenosine analogs and their use MICRODOSE THERAPEUTX, INC. (US) 2013-10-29 — — US disclosed
US-8546557-B2 Methods of making nucleoside tetraphosphate analogs MICRODOSE THERAPEUTX, INC. (US) 2013-10-01 — — US disclosed
US-20110237529-A1 Adenosine Analogs and Their Use MICRODOSE THERAPEUTX, INC 2011-09-29 — — US disclosed
EP-2367837-A2 1'-SUBSTITUTED RIBOSE 5'-POLYPHOSPHATE ANALOGS AND THEIR USE AS MODULATORS OF P2Y RECEPTOR ACTIVITY MicroDose Therapeutx, Inc. (US) 2011-09-28 — — EP disclosed
EP-2303285-A2 METHODS OF MAKING NUCLEOSIDE TETRAPHOSPHATE ANALOGS MicroDose Therapeutx, Inc. (US) 2011-04-06 — — EP disclosed
US-20110046362-A1 METHODS OF MAKING NUCLEOSIDE TETRAPHOSPHATE MICRODOSE THERAPEUTX, INC. 2011-02-24 — — US disclosed
WO-2009102928-A2 METHODS OF MAKING NUCLEOSIDE TETRAPHOSPHATE ANALOGS EPIX DELAWARE, INC. (US) 2009-08-20 — — WO disclosed
WO-2008060632-A2 ADENOSINE ANALOGS AND THEIR USE EPIX DELAWARE, INC. (US) 2008-05-22 — — WO disclosed
US-6764829-B2 DETECTING PARASITES USING CHROMOGENIC SUBSTRATES; OBTAIN SAMPLE, INCUBATE WITH CHROMGENIC SUBSTRATE, DETECT FORMATION OF CHROMOPHORE PRODUCT ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY 2004-07-20 — — US disclosed
US-20020132263-A1 Enzyme detection/assay method and substrates NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2002-09-19 — — US disclosed
US-6379911-B2 ANALYZING NUCLEOSIDE HYDROLASES; DETECTING PARASITES ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY 2002-04-30 — — US disclosed
US-20010019823-A1 ENZYME DETECTION/ASSAY METHOD AND SUBSTRATES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2001-09-06 — — US 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 (5 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-20160129036-A1 ADENOSINE ANALOGS AND THEIR USE P2RY2, P2RY1, P2RY11 TYR 4707/4885SLC5A1 1449/4885SLC5A2 700/4885
US-20110237529-A1 Adenosine Analogs and Their Use P2RY2, P2RY1, P2RY11 TYR 4707/4885SLC5A1 1449/4885SLC5A2 700/4885
US-20110046362-A1 METHODS OF MAKING NUCLEOSIDE TETRAPHOSPHATE P2RY1, P2RY6, NUDT1 TYR 4672/4885SLC5A1 503/4885SLC5A2 767/4885
US-20010019823-A1 ENZYME DETECTION/ASSAY METHOD AND SUBSTRATES PNP, TREH, XDH TYR 264/4885SLC5A1 828/4885SLC5A2 999/4885
US-20140038912-A1 ADENOSINE ANALOGS AND THEIR USE P2RY2, P2RY1, P2RY11 TYR 4643/4885SLC5A1 1337/4885SLC5A2 735/4885

“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.

Send feedback