SCHEMBL8394105

SCHEMBL8394105

NC1O[C@H](COC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@@H]1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.49
▸ USP2 O75604 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ CA1 P00915 2/20 0.45
▸ CA2 P00918 2/20 0.45
▸ CA9 Q16790 1/20 0.45
▸ PTPN1 P18031 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ MAPK1 P28482 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ LGALS9 O00182 1/20 0.43
▸ LGALS1 P09382 1/20 0.43
▸ LGALS3 P17931 1/20 0.43
▸ LGALS7; LGALS7B P47929 1/20 0.43
▸ GAPDH P04406 2/20 0.40
▸ PTPN2 P17706 1/20 0.40
▸ PTPN11 Q06124 1/20 0.40
▸ TSHR P16473 1/20 0.39

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
SCHEMBL8391343 1.00 POLB (0.49) POLBUSP2MEN1KMT2ACA1
SCHEMBL10024427 0.89 POLB (0.46) POLBUSP2MEN1KMT2ACA1
SCHEMBL9771282 0.88 USP2 (0.55) POLBUSP2MEN1KMT2ACA1
SCHEMBL14405371 0.87 USP2 (0.54) POLBUSP2MEN1KMT2ACA1
SCHEMBL7795410 0.87 LGALS3 (0.53) POLBUSP2MEN1KMT2APTPN1
SCHEMBL7798910 0.87 LGALS3 (0.53) POLBUSP2MEN1KMT2APTPN1
SCHEMBL16756804 0.86 POLB (0.50) POLBUSP2MEN1KMT2ACA1
SCHEMBL15959273 0.86 PTPN1 (0.54) POLBUSP2MEN1KMT2ACA1
SCHEMBL21894771 0.86 POLB (0.50) POLBUSP2MEN1KMT2ACA1
SCHEMBL12140889 0.86 PTPN1 (0.54) POLBUSP2MEN1KMT2ACA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5886167-A NUCLEOSIDE ANTIBIOTIC; A COFORMYCIN DERIVATIVE; ENZYME INHIBITOR; USEFUL FOR TREATING LYMPHOCYTIC LEUKEMIA CAUSED BY ADENOSINE DEAMINASE ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1999-03-23 — — US disclosed
US-5831072-A Process for the preparation of 2'-deoxy-2'-halocoformycins or steroisomers thereof ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1998-11-03 — — US disclosed
US-5773607-A MULTISTAGE PROCESS WITH REDUCTION AND CYCLIZATION FOR FORMATION OF ENZYME INHIBITORS OF ADENOSINE DEAMINASE AS ANTITUMOR AGENTS AND ANTICARCINOGENIC AGENTS AND BACTERICIDES ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1998-06-30 — — US disclosed
EP-0643069-B1 2'-DEOXY-2'-FLUOROCOFORMYCIN AND STEREOISOMERS THEREOF ZAIDAN HOJIN BISEIBUTSU (JP) 1997-03-05 — — EP disclosed
EP-0643069-A1 2'-DEOXY-2'-FLUOROCOFORMYCIN AND STEREOISOMERS THEREOF ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1995-03-15 — — EP disclosed
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