SCHEMBL9851728

SCHEMBL9851728

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

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ATG7 O95352 1/20 0.43
ALDH1A1 P00352 2/20 0.38
STING1 Q86WV6 1/20 0.38
P2RX3 P56373 1/20 0.38
NT5E P21589 2/20 0.36
TYMP P19971 2/20 0.36
MAPT P10636 1/20 0.35
GSK3A P49840 2/20 0.35
RPS6KA3 P51812 2/20 0.35
MAPK14 Q16539 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
HPRT1 P00492 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 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
SCHEMBL9851884 0.92 ATG7 (0.43) ATG7ALDH1A1STING1P2RX3NT5E
SCHEMBL9851819 0.91 ALDH1A1 (0.42) ATG7ALDH1A1STING1P2RX3NT5E
SCHEMBL9851811 0.91 ALDH1A1 (0.40) ATG7ALDH1A1STING1P2RX3NT5E
SCHEMBL9851743 0.91 ATG7 (0.52) ATG7ALDH1A1STING1P2RX3NT5E
SCHEMBL9851790 0.84 ALDH1A1 (0.42) ATG7ALDH1A1STING1P2RX3MAPT
SCHEMBL9851742 0.82 ALDH1A1 (0.40) ATG7ALDH1A1STING1P2RX3TYMP
SCHEMBL6912039 0.79 ALDH1A1 (0.55) ATG7ALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL6912032 0.79 ALDH1A1 (0.55) ATG7ALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL1144829 0.79 ALDH1A1 (0.55) ATG7ALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL18520579 0.79 ATG7 (0.51) ATG7ALDH1A1P2RX3NT5ETYMP

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