SCHEMBL29922159

SCHEMBL29922159

COCC1(COC)OC(=O)c2ccc(N)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
FTO Q9C0B1 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
NPC1 O15118 3/20 0.35
ALDH1A1 P00352 3/20 0.35
RAB9A P51151 3/20 0.35
TDP1 Q9NUW8 2/20 0.35
CYP3A4 P08684 2/20 0.35
TSHR P16473 2/20 0.35
MAPK1 P28482 2/20 0.35
TP53 P04637 1/20 0.35
LMNA P02545 4/20 0.35
MAPT P10636 3/20 0.35
GAA P10253 2/20 0.35
PTPRC P08575 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
HPGD P15428 2/20 0.34
HTT P42858 2/20 0.34

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
SCHEMBL29922061 0.92 POLB (0.35) POLBMEN1KMT2AFTOSMN1; SMN2
SCHEMBL21013530 0.75 POLB (0.46) POLBMEN1KMT2AFTOSMN1; SMN2
SCHEMBL29606664 0.75 POLB (0.46) POLBMEN1KMT2AFTOSMN1; SMN2
Hydrochloric Acid SCHEMBL30504137 0.74 POLB (0.45) POLBMEN1KMT2AFTOSMN1; SMN2
SCHEMBL29922012 0.71 POLB (0.42) POLBMEN1KMT2AFTOSMN1; SMN2
SCHEMBL6741228 0.70 MEN1 (0.50) POLBMEN1KMT2AFTOSMN1; SMN2
SCHEMBL29921913 0.69 POLB (0.41) POLBMEN1KMT2AFTOSMN1; SMN2
SCHEMBL6742481 0.67 MEN1 (0.54) POLBMEN1KMT2AFTOSMN1; SMN2
SCHEMBL12969896 0.65 SMN1; SMN2 (0.45) POLBMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL29922416 0.65 POLB (0.40) POLBMEN1KMT2AFTOSMN1; SMN2

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
WO-2022188735-A1 HETEROCYCLIC COMPOUNDS AS HPK1 INHIBITORS GUANGDONG NEWOPP BIOPHARMACEUTICALS CO., LTD. (CN) 2022-09-15 WO disclosed