SCHEMBL9851816

SCHEMBL9851816

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

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
ATG7 O95352 1/20 0.34
STING1 Q86WV6 1/20 0.34
ADORA2A P29274 2/20 0.33
ADORA2B P29275 2/20 0.33
TK2 O00142 2/20 0.32
TYMP P19971 1/20 0.32
ADORA1 P30542 1/20 0.32

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
SCHEMBL9851765 0.93 ATG7 (0.36) MEN1KMT2ASMN1; SMN2ALDH1A1LMNA
SCHEMBL9851862 0.90 MEN1 (0.39) MEN1KMT2ASMN1; SMN2ALDH1A1LMNA
SCHEMBL9851747 0.83 SMN1; SMN2 (0.39) MEN1KMT2ASMN1; SMN2ALDH1A1LMNA
SCHEMBL9851859 0.83 ALDH1A1 (0.39) MEN1KMT2ASMN1; SMN2ALDH1A1LMNA
SCHEMBL9851775 0.82 ATG7 (0.44) ATG7TYMP
SCHEMBL9851837 0.82 ALDH1A1 (0.35) ALDH1A1LMNASTING1
SCHEMBL9851790 0.81 ALDH1A1 (0.42) MEN1KMT2ASMN1; SMN2ALDH1A1LMNA
SCHEMBL9851748 0.81 ATG7 (0.39) ALDH1A1ATG7STING1TYMP
SCHEMBL6912032 0.79 ALDH1A1 (0.55) MEN1KMT2ASMN1; SMN2ALDH1A1LMNA
SCHEMBL1144829 0.79 ALDH1A1 (0.55) MEN1KMT2ASMN1; SMN2ALDH1A1LMNA

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