SCHEMBL9851711

SCHEMBL9851711

O=c1[nH]cnc2c1cnn2[C@@H]1O[C@H](COCc2ccccc2)C[C@H]1O

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.45
LMNA P02545 1/20 0.40
TYMP P19971 2/20 0.39
HRH4 Q9H3N8 4/20 0.39
HRH3 Q9Y5N1 4/20 0.39
NT5E P21589 1/20 0.38
STING1 Q86WV6 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
IP6K1 Q92551 1/20 0.36
HPRT1 P00492 1/20 0.36
PDE2A O00408 1/20 0.35
PDE9A O76083 1/20 0.35

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
SCHEMBL9851703 0.88 MAPT (0.44) MAPTLMNATYMPHRH4HRH3
SCHEMBL9851738 0.84 STING1 (0.40) MAPTLMNATYMPNT5ESTING1
SCHEMBL9851718 0.83 HSPA5 (0.48) MAPTTYMPNT5EMEN1KMT2A
SCHEMBL9851714 0.82 ALDH1A1 (0.43) MAPTLMNANT5ESTING1MEN1
SCHEMBL9851855 0.82 NT5E (0.37) MAPTLMNATYMPNT5ESTING1
SCHEMBL9851809 0.81 MAPT (0.46) MAPTLMNASTING1MEN1KMT2A
SCHEMBL9851796 0.80 MAPT (0.44) MAPTTYMPMEN1KMT2APDE2A
SCHEMBL9851822 0.80 MAPT (0.44) MAPTTYMPNT5EMEN1KMT2A
SCHEMBL9851804 0.80 NT5E (0.41) MAPTLMNATYMPNT5ESTING1
SCHEMBL9851876 0.76 NT5E (0.40) MAPTLMNATYMPNT5ESTING1

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