SCHEMBL9851743

SCHEMBL9851743

O=c1[nH]cnc2c1cnn2[C@@H]1O[C@H](CO[SiH3])[C@@H](O)[C@H]1O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ATG7 O95352 1/20 0.52
P2RX3 P56373 1/20 0.46
NT5E P21589 3/20 0.44
TYMP P19971 3/20 0.43
GSK3A P49840 2/20 0.42
RPS6KA3 P51812 2/20 0.42
MAPK14 Q16539 2/20 0.42
HPRT1 P00492 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
STING1 Q86WV6 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
SCHEMBL9851884 0.91 ATG7 (0.43) ATG7P2RX3NT5ETYMPGSK3A
SCHEMBL9851728 0.91 ATG7 (0.43) ATG7P2RX3NT5ETYMPGSK3A
SCHEMBL18520579 0.88 ATG7 (0.51) ATG7P2RX3NT5ETYMPGSK3A
SCHEMBL1144829 0.86 ALDH1A1 (0.55) ATG7SMN1; SMN2ALDH1A1LMNAPOLB
SCHEMBL6912032 0.86 ALDH1A1 (0.55) ATG7SMN1; SMN2ALDH1A1LMNAPOLB
SCHEMBL6912039 0.86 ALDH1A1 (0.55) ATG7SMN1; SMN2ALDH1A1LMNAPOLB
SCHEMBL9851811 0.85 ALDH1A1 (0.40) ATG7P2RX3NT5ETYMPGSK3A
SCHEMBL9851873 0.85 ATG7 (0.48) ATG7P2RX3NT5ETYMPGSK3A
SCHEMBL9851718 0.83 HSPA5 (0.48) ATG7P2RX3NT5ETYMPGSK3A
SCHEMBL9851819 0.83 ALDH1A1 (0.42) ATG7P2RX3NT5ETYMPHPRT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0450102-A1 NUCLEOSIDE DERIVATIVE Yamasa Shoyu Kabushiki Kaisha (JP) 1991-10-09 EP disclosed