SCHEMBL9339166

SCHEMBL9339166

O=c1[nH]c(=O)n([C@@]2(Cc3ccccc3)C[C@H](O)[C@@H](CO)O2)cc1F

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TYMS P04818 1/20 0.35
ALOX12 P18054 1/20 0.34
ADRA1A P35348 1/20 0.34
TK1 P04183 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL9343126 0.91 LMNA (0.43) LMNASMN1; SMN2ALOX12ADRA1ATK1
SCHEMBL8527788 0.88 TK1 (0.41) TK1
SCHEMBL10583599 0.86 LMNA (0.41) LMNASMN1; SMN2ALOX12ADRA1ATK1
Ethylene SCHEMBL28028336 0.86 TK1 (0.40) TK1
SCHEMBL30241241 0.85 LMNA (0.49) LMNASMN1; SMN2ALOX12ADRA1ATK1
SCHEMBL10585351 0.85 LMNA (0.40) LMNASMN1; SMN2ALOX12ADRA1ATK1
SCHEMBL10581354 0.82 LMNA (0.41) LMNASMN1; SMN2ALOX12ADRA1ATK1
SCHEMBL15285199 0.82 SLC28A1 (0.40)
Hydrochloric Acid SCHEMBL10585698 0.82 LMNA (0.41) LMNASMN1; SMN2ALOX12ADRA1ATK1
SCHEMBL9339149 0.79 LMNA (0.43) LMNASMN1; SMN2ALOX12ADRA1ATK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0301873-B1 2'-deoxy-5-fluorouridine derivatives TAIHO PHARMACEUTICAL CO LTD (JP) 1994-06-08 EP disclosed
EP-0301873-A2 2'-deoxy-5-fluorouridine derivatives TAIHO PHARMACEUTICAL CO., LTD. (JP) 1989-02-01 EP disclosed