SCHEMBL9851704

SCHEMBL9851704

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

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
STING1 Q86WV6 1/20 0.36
MAPT P10636 1/20 0.36
LMNA P02545 1/20 0.35
ALB P02768 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ATG7 O95352 1/20 0.32
P2RX3 P56373 1/20 0.31
TYMP P19971 1/20 0.30
GSK3A P49840 1/20 0.30
RPS6KA3 P51812 1/20 0.30
MAPK14 Q16539 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
SCHEMBL9851757 0.91 ALDH1A1 (0.40) ALDH1A1STING1MAPTLMNAALB
SCHEMBL9851738 0.88 STING1 (0.40) ALDH1A1STING1MAPTLMNAALB
SCHEMBL9851811 0.79 ALDH1A1 (0.40) ALDH1A1STING1MAPTLMNAHTT
SCHEMBL9851701 0.79 ALDH1A1 (0.37) ALDH1A1STING1MAPTLMNAALB
SCHEMBL9851793 0.79 ALDH1A1 (0.37) ALDH1A1STING1MAPTLMNAALB
SCHEMBL9851703 0.77 MAPT (0.44) ALDH1A1STING1MAPTLMNAMEN1
SCHEMBL9851743 0.77 ATG7 (0.52) ALDH1A1STING1LMNAATG7P2RX3
SCHEMBL9851884 0.76 ATG7 (0.43) ALDH1A1STING1MAPTMEN1KMT2A
SCHEMBL9851820 0.76 ALDH1A1 (0.39) ALDH1A1STING1MAPTLMNAALB
SCHEMBL9851856 0.76 ALDH1A1 (0.39) ALDH1A1STING1MAPTLMNAALB

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