SCHEMBL187972

SCHEMBL187972

Cc1cn([C@H]2C[C@@](O)(F)[C@@H](COP(=O)(O)O)O2)c(=S)[nH]c1=O

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TK1 P04183 4/20 0.50
POLB P06746 2/20 0.41
TYMS P04818 1/20 0.40
POLA1 P09884 1/20 0.39
POLD1 P28340 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
SCHEMBL187710 0.92 TK1 (0.41) TK1POLBPOLA1POLD1
SCHEMBL187829 0.90 TK1 (0.62) TK1POLBTYMSPOLA1POLD1
SCHEMBL187841 0.86 TK1 (0.50) TK1POLBTYMS
SCHEMBL186844 0.83 TK1 (0.51) TK1POLBPOLA1POLD1
SCHEMBL8815106 0.81 POLB (0.60) TK1POLBPOLA1POLD1
SCHEMBL187924 0.80 TK1 (0.41) TK1POLBPOLA1POLD1
SCHEMBL9083809 0.78 POLA1 (0.50) TK1POLBPOLA1POLD1
SCHEMBL30564142 0.78 TK1 (0.57) TK1POLBTYMSPOLA1POLD1
SCHEMBL3204369 0.78 POLB (0.65) TK1POLBTYMS
Phosphoric Acid SCHEMBL1445017 0.76 TK1 (0.53) TK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2402357-A1 Analogs of 2',3'-dideoxy-3'-fluorothymidine 5'-monophosphate (FLTMP) for treatment human immunodeficiency virus (HIV), their application and pharmaceutically acceptable form of drug Instytut Biochemii I Biofizyki Pan (PL) 2012-01-04 EP claimed
EP-2402357-B1 Analogs of 2',3'-dideoxy-3'-fluorothymidine 5'-monophosphate (FLTMP) for use in the treatment of infections caused by human HIV-1 strains INST BIOCHEMII I BIOFIZYKI PAN (PL) 2015-10-14 EP disclosed
EP-2402357-A1 Analogs of 2',3'-dideoxy-3'-fluorothymidine 5'-monophosphate (FLTMP) for treatment human immunodeficiency virus (HIV), their application and pharmaceutically acceptable form of drug Instytut Biochemii I Biofizyki Pan (PL) 2012-01-04 EP disclosed
EP-2402357-A1 Analogs of 2',3'-dideoxy-3'-fluorothymidine 5'-monophosphate (FLTMP) for treatment human immunodeficiency virus (HIV), their application and pharmaceutically acceptable form of drug Instytut Biochemii I Biofizyki Pan (PL) 2012-01-04 EP disclosed