SCHEMBL9552004

SCHEMBL9552004

CS(=O)(=O)OC1C[C@@H](n2ccc(=O)[nH]c2=O)O[C@H]1COC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DUT P33316 11/20 0.50
TYMP P19971 1/20 0.42
HSP90AA1 P07900 1/20 0.37
RNASE1 P07998 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
P2RY12 Q9H244 3/20 0.35
P2RY2 P41231 3/20 0.35
P2RY4 P51582 1/20 0.34

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
SCHEMBL9221159 1.00 DUT (0.50) DUTTYMPHSP90AA1RNASE1MEN1
SCHEMBL3925356 1.00 DUT (0.50) DUTTYMPHSP90AA1RNASE1MEN1
SCHEMBL29722701 0.88 DUT (0.54) DUTTYMPHSP90AA1RNASE1P2RY12
SCHEMBL5475154 0.85 RNASE1 (0.53) RNASE1
SCHEMBL5489355 0.85 RNASE1 (0.53) RNASE1
SCHEMBL5475148 0.85 RNASE1 (0.53) RNASE1
SCHEMBL30976656 0.85 RNASE1 (0.53) RNASE1
SCHEMBL5489351 0.85 RNASE1 (0.53) RNASE1
SCHEMBL9810769 0.85 TK1 (0.43) TYMPRNASE1
SCHEMBL9810774 0.85 TK1 (0.43) TYMPRNASE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5190926-A HIV virus UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 1993-03-02 US disclosed
US-5159067-A 5'-Diphosphohexose nucleoside pharmaceutical compositions UNIVERSITY OF GEORGIA RESEARCH FOUNDATION INC. (US) 1992-10-27 US disclosed
US-5145840-A Treatment of virac and bacterial infections; aids BURROUGHS WELLCOME CO. (US) 1992-09-08 US disclosed
US-5118672-A Microbiocides, viricides, bactericides UNIVERSITY OF GEORGIA RESEARCH FOUNDATION (US) 1992-06-02 US disclosed
US-5064946-A 3-azido-2,3-dideoxy-B-D-erythro-pentofuranosyl derivatives of 4(1H)-pyrimidinones; antiretroviral, anti-AIDS BURROUGHS WELLCOME CO. (US) 1991-11-12 US disclosed
WO-1991000867-A1 5'-DIPHOSPHOHEXOSE NUCLEOSIDE PHARMACEUTICAL COMPOSITIONS UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 1991-01-24 WO disclosed
EP-0301064-A1 3'-AZIDO-2',3'-DIDEOXYURIDINE ANTI-RETROVIRAL COMPOSITION. CHU CHUNG K (US) 1989-02-01 EP disclosed
WO-1988005657-A1 3'-AZIDO-2',3'-DIDEOXYURIDINE ANTI-RETROVIRAL COMPOSITION CHU CHUNG K (US) 1988-08-11 WO disclosed
EP-0217580-A2 Therapeutic nucleosides THE WELLCOME FOUNDATION LIMITED (GB) 1987-04-08 EP disclosed