SCHEMBL3450684

SCHEMBL3450684

Nc1ncnc2c1ncn2[C@]1(CC(c2ccccc2)c2ccccc2)O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 5/20 0.48
POLB P06746 1/20 0.48
ADORA2A P29274 3/20 0.48
GMPS P49915 1/20 0.48
PI4KA P42356 2/20 0.47
PI4K2B Q8TCG2 2/20 0.47
PI4K2A Q9BTU6 2/20 0.47
PI4KB Q9UBF8 2/20 0.47
ADORA2B P29275 2/20 0.47
ADORA1 P30542 2/20 0.47
GAPDH P04406 2/20 0.47
SLC28A1 O00337 2/20 0.47
DPP4 P27487 1/20 0.47
MEN1 O00255 1/20 0.47
MAP3K7 O43318 1/20 0.47
SLC28A2 O43868 1/20 0.47
MAPK1 P28482 1/20 0.47
STAT6 P42226 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL10711083 0.95 ADORA3 (0.45) ADORA3POLBADORA2AGMPSPI4KA
SCHEMBL10712341 0.95 ADORA3 (0.44) ADORA3POLBADORA2AGMPSPI4KA
SCHEMBL10709847 0.93 ADORA3 (0.43) ADORA3POLBADORA2AGMPSPI4KA
SCHEMBL10707529 0.92 ADORA3 (0.47) ADORA3POLBADORA2AGMPSPI4KA
SCHEMBL5180925 0.92 ADORA3 (0.46) ADORA3POLBADORA2AGMPSPI4KA
SCHEMBL10709090 0.92 SLC28A2 (0.43) ADORA3POLBADORA2AGMPSPI4KA
SCHEMBL10707448 0.92 ADORA3 (0.42) ADORA3POLBADORA2AGMPSPI4KA
SCHEMBL11016801 0.92 ADORA3 (0.46) ADORA3POLBADORA2AGMPSPI4KA
SCHEMBL10599784 0.91 GMPS (0.45) ADORA3POLBADORA2AGMPSPI4KA
SCHEMBL10709861 0.90 ADORA3 (0.46) ADORA3POLBADORA2AGMPSPI4KA

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0181129-B1 N6-SUBSTITUTED DEOXYRIBOSE ANALOGS OF ADENOSINES WARNER-LAMBERT COMPANY (US) 1989-03-08 EP claimed
EP-0139358-B1 N6-SUBSTITUTED DIARYLALKYL ADENOSINES, PROCESSES FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME WARNER-LAMBERT COMPANY (US) 1988-11-09 EP claimed
EP-0181129-A2 N6-substituted deoxyribose analogs of adenosines WARNER-LAMBERT COMPANY (US) 1986-05-14 EP claimed
EP-0175465-A1 An association of, or composition comprising, haloperidol and a diphenylalkyl adenosine or a diphenylalkyl-2-amino adenosine WARNER-LAMBERT COMPANY (US) 1986-03-26 EP claimed
EP-0139358-A2 N6-substituted diarylalkyl adenosines, processes for their production and pharmaceutical compositions comprising the same WARNER-LAMBERT COMPANY (US) 1985-05-02 EP claimed
US-10675278-B2 Crush resistant delayed-release dosage forms Grünenthal GmbH (DE) 2020-06-09 US disclosed
US-20180369235-A1 CRUSH RESISTANT DELAYED-RELEASE DOSAGE FORMS Grünenthal GmbH (DE) 2018-12-27 US disclosed
US-20170312271-A1 CRUSH RESISTANT DELAYED-RELEASE DOSAGE FORMS Grünenthal GmbH (DE) 2017-11-02 US disclosed
EP-2478896-B1 Fracture-resistant application forms with delayed release GRUENENTHAL GMBH (DE) 2017-09-06 EP disclosed
EP-1845956-B1 BREAK-RESISTANT DELAYED-RELEASE FORMS OF ADMINISTRATION GRUENENTHAL GMBH (DE) 2017-03-22 EP disclosed
US-20160184297-A1 CRUSH RESISTANT DELAYED-RELEASE DOSAGE FORMS Grünenthal GmbH (DE) 2016-06-30 US disclosed
US-20160120810-A1 CRUSH RESISTANT DELAYED-RELEASE DOSAGE FORMS Grünenthal GmbH (DE) 2016-05-05 US disclosed
EP-1019427-A1 N?6 -SUBSTITUTED-ADENOSINE-5'-URONAMIDES AS ADENOSINE RECEPTOR MODULATORS Medco Research, Inc. (US) 2000-07-19 EP disclosed
WO-1999006053-A1 N6-SUBSTITUTED-ADENOSINE-5'-URONAMIDES AS ADENOSINE RECEPTOR MODULATORS MEDCO RESEARCH, INC. (US) 1999-02-11 WO disclosed
WO-1996002553-A2 AMINO PURINE-β-D-RIBOFURANURONAMIDE DERIVATIVES GLAXO GROUP LIMITED (GB) 1996-02-01 WO disclosed
EP-0181129-B1 N6-SUBSTITUTED DEOXYRIBOSE ANALOGS OF ADENOSINES WARNER-LAMBERT COMPANY (US) 1989-03-08 EP disclosed
EP-0139358-B1 N6-SUBSTITUTED DIARYLALKYL ADENOSINES, PROCESSES FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME WARNER-LAMBERT COMPANY (US) 1988-11-09 EP disclosed
EP-0181129-A2 N6-substituted deoxyribose analogs of adenosines WARNER-LAMBERT COMPANY (US) 1986-05-14 EP disclosed
EP-0175465-A1 An association of, or composition comprising, haloperidol and a diphenylalkyl adenosine or a diphenylalkyl-2-amino adenosine WARNER-LAMBERT COMPANY (US) 1986-03-26 EP disclosed
EP-0139358-A2 N6-substituted diarylalkyl adenosines, processes for their production and pharmaceutical compositions comprising the same WARNER-LAMBERT COMPANY (US) 1985-05-02 EP disclosed