SCHEMBL9851811

SCHEMBL9851811

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.37
ATG7 O95352 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 1/20 0.34
THRB P10828 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HIF1A Q16665 1/20 0.34
STING1 Q86WV6 1/20 0.34
P2RX3 P56373 1/20 0.33
HTT P42858 1/20 0.33
TYMP P19971 1/20 0.32
USP2 O75604 1/20 0.32
POLB P06746 1/20 0.32
GSK3A P49840 2/20 0.31
RPS6KA3 P51812 2/20 0.31
MAPK14 Q16539 2/20 0.31
NT5E P21589 1/20 0.31
HPRT1 P00492 1/20 0.30

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) ALDH1A1MAPTATG7MEN1KMT2A
SCHEMBL9851742 0.89 ALDH1A1 (0.40) ALDH1A1MAPTATG7MEN1KMT2A
SCHEMBL9851743 0.85 ATG7 (0.52) ALDH1A1ATG7LMNASMN1; SMN2STING1
SCHEMBL9851790 0.83 ALDH1A1 (0.42) ALDH1A1MAPTATG7MEN1KMT2A
SCHEMBL9851704 0.79 ALDH1A1 (0.39) ALDH1A1MAPTATG7MEN1KMT2A
SCHEMBL9851738 0.77 STING1 (0.40) ALDH1A1MAPTATG7MEN1KMT2A
SCHEMBL9851812 0.76 ALDH1A1 (0.39) ALDH1A1MAPTATG7MEN1KMT2A
SCHEMBL9851757 0.73 ALDH1A1 (0.40) ALDH1A1MAPTATG7MEN1KMT2A
SCHEMBL18520579 0.73 ATG7 (0.51) ALDH1A1ATG7LMNASMN1; SMN2P2RX3
SCHEMBL6912032 0.73 ALDH1A1 (0.55) ALDH1A1MAPTATG7MEN1KMT2A

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