SCHEMBL7529299

SCHEMBL7529299

COc1ccc(C(OC[C@H]2O[C@@H](n3cnc4c(NC(=O)c5ccccc5)ncnc43)[C@H](O)[C@@H]2O)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TYMP P19971 8/20 0.67
P2RY12 Q9H244 2/20 0.56
ADORA1 P30542 3/20 0.55
P2RY2 P41231 1/20 0.54
P2RY1 P47900 1/20 0.54
P2RY6 Q15077 1/20 0.54
DNPH1 O43598 1/20 0.53

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
SCHEMBL19493363 1.00 TYMP (0.67) TYMPP2RY12ADORA1P2RY2P2RY1
SCHEMBL17304362 1.00 TYMP (0.67) TYMPP2RY12ADORA1P2RY2P2RY1
SCHEMBL917680 1.00 TYMP (0.67) TYMPP2RY12ADORA1P2RY2P2RY1
SCHEMBL917678 1.00 TYMP (0.67) TYMPP2RY12ADORA1P2RY2P2RY1
SCHEMBL19493362 1.00 TYMP (0.67) TYMPP2RY12ADORA1P2RY2P2RY1
SCHEMBL29679722 1.00 TYMP (0.67) TYMPP2RY12ADORA1P2RY2P2RY1
SCHEMBL8386141 1.00 TYMP (0.67) TYMPP2RY12ADORA1P2RY2P2RY1
SCHEMBL7529826 0.99 TYMP (0.66) TYMPP2RY12ADORA1P2RY2P2RY1
SCHEMBL9024707 0.94 TYMP (0.69) TYMPP2RY12ADORA1P2RY2P2RY1
SCHEMBL9550751 0.94 TYMP (0.69) TYMPP2RY12ADORA1P2RY2P2RY1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1186306-A1 Labeled nucleosides and method for their preparation K.U. Leuven Research & Development (BE) 2002-03-13 EP disclosed
EP-0694559-B1 2',5'-Phosphorothioate oligoadenylates and antiviral uses thereof UNIV TEMPLE (US) 1999-04-14 EP disclosed
US-5556840-A 2',5'-phosphorothioate oligoadenylates as anitiviral agents TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 1996-09-17 US disclosed
EP-0389521-B1 2',5'-PHOSPHOROTHIOATE OLIGOADENYLATES AND ANTIVIRAL USES THEREOF UNIV TEMPLE (US) 1996-03-20 EP disclosed
EP-0694559-A2 2',5'-Phosphorothioate oligoadenylates and antiviral uses thereof Temple University of the Commonwealth System of Higher Education (US) 1996-01-31 EP disclosed
US-5405939-A viricides TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 1995-04-11 US disclosed
US-5188897-A Viricides, metabolic stability TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 1993-02-23 US disclosed
EP-0389521-A4 2',5'-PHOSPHOROTHIOATE OLIGOADENYLATES AND ANTIVIRAL USES THEREOF 1992-02-05 EP disclosed
EP-0389521-A1 2',5'-PHOSPHOROTHIOATE OLIGOADENYLATES AND ANTIVIRAL USES THEREOF Temple University of the Commonwealth System of Higher Education (US) 1990-10-03 EP disclosed
US-4924624-A TOBACCO MOSAIC VIRUS TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 1990-05-15 US disclosed
WO-1989003683-A1 2',5'-PHOSPHOROTHIOATE OLIGOADENYLATES AND ANTIVIRAL USES THEREOF TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HI (US) 1989-05-05 WO disclosed