SCHEMBL23917749

SCHEMBL23917749

Nc1c(O)cc(O)c(O)c1O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SELL P14151 2/20 0.36
SELP P16109 2/20 0.36
SELE P16581 1/20 0.36
TDP1 Q9NUW8 5/20 0.35
RECQL P46063 4/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
APEX1 P27695 3/20 0.35
THRB P10828 2/20 0.35
RAD52 P43351 2/20 0.35
BLM P54132 2/20 0.35
GAPDH P04406 1/20 0.35
MAPT P10636 5/20 0.34
ALDH1A1 P00352 4/20 0.34
GAA P10253 2/20 0.34
KDM4E B2RXH2 3/20 0.33
HSD17B10 Q99714 3/20 0.33
ALOX15 P16050 2/20 0.33
MAPK1 P28482 2/20 0.33
AGO2 Q9UKV8 1/20 0.33

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
SCHEMBL5710865 0.79 ALOX15 (0.36) SELLSELPSELETDP1RECQL
Hydrochloric Acid SCHEMBL7804362 0.77 ALOX15 (0.35) SELLSELPSELETDP1RECQL
SCHEMBL19511839 0.76 ALDH1A1 (0.39) TDP1RECQLMEN1KMT2AAPEX1
SCHEMBL1961108 0.75 SELL (0.47) SELLSELPSELETDP1RECQL
SCHEMBL13474834 0.75 ALDH1A1 (0.50) SELLSELPSELETDP1RECQL
SCHEMBL6268650 0.73 ALOX15 (0.36) RECQLMEN1KMT2ATHRBMAPT
Ethylene SCHEMBL27790567 0.69 SELL (0.42) SELLSELPSELETDP1RECQL
Ethane SCHEMBL4867811 0.69 SELL (0.50) SELLSELPSELETDP1RECQL
SCHEMBL30023765 0.69 KDM4E (0.47) SELLSELPTDP1RECQLMEN1
SCHEMBL13064872 0.69 KDM4E (0.47) SELLSELPTDP1RECQLMEN1

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-3892602-A1 METHOD FOR THE PREPARATION OF DEUTERATED OR TRITIATED COMPOUNDS Friedrich-Alexander-Universität Erlangen-Nürnberg (DE) 2021-10-13 EP disclosed