SCHEMBL9851859

SCHEMBL9851859

CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](CO)O[C@H]1n1ncc2c(=O)[nH]cnc21

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
HTT P42858 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPT P10636 1/20 0.34
ATG7 O95352 1/20 0.34
STING1 Q86WV6 1/20 0.34
LMNA P02545 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
ALB P02768 1/20 0.33
MAPK1 P28482 1/20 0.33
POLB P06746 1/20 0.33
THRB P10828 1/20 0.32
HIF1A Q16665 1/20 0.32
TYMP P19971 2/20 0.32
P2RX3 P56373 1/20 0.31
SLC28A2 O43868 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
SCHEMBL9851862 0.92 MEN1 (0.39) ALDH1A1MEN1KMT2AMAPTATG7
SCHEMBL9851747 0.92 SMN1; SMN2 (0.39) ALDH1A1MEN1KMT2AMAPTATG7
SCHEMBL9851812 0.89 ALDH1A1 (0.39) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL9851748 0.85 ATG7 (0.39) ALDH1A1MAPTATG7STING1TYMP
SCHEMBL9851765 0.83 ATG7 (0.36) ALDH1A1MEN1KMT2AMAPTATG7
SCHEMBL9851816 0.83 MEN1 (0.37) ALDH1A1MEN1KMT2AATG7STING1
SCHEMBL9851742 0.83 ALDH1A1 (0.40) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL9851856 0.82 ALDH1A1 (0.39) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL21859254 0.79 TYMP (0.49) ALDH1A1STING1LMNAALBMAPK1
SCHEMBL9851819 0.79 ALDH1A1 (0.42) ALDH1A1MEN1KMT2AMAPTATG7

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