SCHEMBL9851884

SCHEMBL9851884

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

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ATG7 O95352 1/20 0.43
P2RX3 P56373 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TYMP P19971 3/20 0.38
STING1 Q86WV6 1/20 0.38
GSK3A P49840 2/20 0.37
RPS6KA3 P51812 2/20 0.37
MAPK14 Q16539 2/20 0.37
NT5E P21589 2/20 0.36
HPRT1 P00492 1/20 0.36
MAPT P10636 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HINT1 P49773 1/20 0.34

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
SCHEMBL9851728 0.92 ATG7 (0.43) ATG7P2RX3ALDH1A1TYMPSTING1
SCHEMBL9851790 0.91 ALDH1A1 (0.42) ATG7P2RX3ALDH1A1STING1MAPT
SCHEMBL9851743 0.91 ATG7 (0.52) ATG7P2RX3ALDH1A1TYMPSTING1
SCHEMBL9851811 0.91 ALDH1A1 (0.40) ATG7P2RX3ALDH1A1TYMPSTING1
SCHEMBL9851819 0.84 ALDH1A1 (0.42) ATG7P2RX3ALDH1A1TYMPSTING1
SCHEMBL9851742 0.84 ALDH1A1 (0.40) ATG7P2RX3ALDH1A1TYMPSTING1
SCHEMBL18520579 0.79 ATG7 (0.51) ATG7P2RX3ALDH1A1TYMPGSK3A
SCHEMBL9851748 0.79 ATG7 (0.39) ATG7P2RX3ALDH1A1TYMPSTING1
SCHEMBL9851738 0.78 STING1 (0.40) ATG7P2RX3ALDH1A1TYMPSTING1
SCHEMBL9851796 0.78 MAPT (0.44) ATG7TYMPGSK3ARPS6KA3MAPK14

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