SCHEMBL7806784

SCHEMBL7806784

CC(=O)O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1n1cc(F)c(=O)[nH]c1=O

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TK2 O00142 5/20 0.54
LMNA P02545 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
TSHR P16473 1/20 0.52
MAPT P10636 1/20 0.52
PMP22 Q01453 1/20 0.52
HBB P68871 1/20 0.52
PYGM P11217 3/20 0.52
NT5E P21589 1/20 0.51
P2RY6 Q15077 1/20 0.51
P2RY14 Q15391 1/20 0.51
CD69 Q07108 1/20 0.49

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
SCHEMBL10895353 0.90 LMNA (0.56) TK2LMNASMN1; SMN2TSHRMAPT
SCHEMBL6536580 0.90 LMNA (0.51) TK2LMNASMN1; SMN2TSHRMAPT
SCHEMBL7800239 0.90 P2RY6 (0.54) TK2LMNASMN1; SMN2TSHRMAPT
SCHEMBL18503446 0.86 LMNA (0.47) TK2LMNASMN1; SMN2TSHRMAPT
SCHEMBL17198346 0.85 P2RY6 (0.46) TK2LMNASMN1; SMN2TSHRMAPT
SCHEMBL28113579 0.84 LMNA (0.56) TK2LMNASMN1; SMN2TSHRMAPT
SCHEMBL659077 0.84 LMNA (0.56) TK2LMNASMN1; SMN2TSHRMAPT
SCHEMBL659076 0.84 LMNA (0.56) TK2LMNASMN1; SMN2TSHRMAPT
5-Fluorouridine SCHEMBL17173362 0.84 PYGM (0.70) TK2LMNASMN1; SMN2TSHRMAPT
5-Fluorouridine SCHEMBL329381 0.84 PYGM (0.70) TK2LMNASMN1; SMN2TSHRMAPT

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
EP-0851866-B1 THERAPEUTIC COMPOUNDS OXFORD GLYCOSCIENCES UK LTD (GB) 2001-08-29 EP claimed
EP-0851866-B1 THERAPEUTIC COMPOUNDS OXFORD GLYCOSCIENCES UK LTD (GB) 2001-08-29 EP disclosed
US-5945406-A ANTICANCER AGENTS; TREATMENT FOR METASTATIC LIVER CANCER, FUNGAL INFECTIONS, PSORIASIS; USED IN MANUFACTURE OF DRUGSTO PREVENT CELL DIVISION OXFORD GLYCOSCIENCES (UK) LTD. (GB) 1999-08-31 US disclosed
EP-0851866-A1 THERAPEUTIC COMPOUNDS Oxford GlycoSciences (UK) Limited (GB) 1998-07-08 EP disclosed
WO-1997000882-A1 THERAPEUTIC COMPOUNDS OXFORD GLYCOSCIENCES (UK) LIMITED (GB) 1997-01-09 WO disclosed