SCHEMBL28356202

SCHEMBL28356202

CCOC(=O)c1nc(CCc2ccc(OC)cc2)oc1OCC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TARBP2 Q15633 2/20 0.51
PDCD4 Q53EL6 1/20 0.51
RXFP1 Q9HBX9 1/20 0.47
POLB P06746 2/20 0.46
KMT2A Q03164 2/20 0.44
GLA P06280 1/20 0.44
MAPT P10636 5/20 0.44
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
HSP90AA1 P07900 1/20 0.44
MAOB P27338 1/20 0.43
GAA P10253 1/20 0.43
LMNA P02545 2/20 0.42
P2RX3 P56373 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
MEN1 O00255 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL14704236 0.82 RAB9A (0.45) POLBKMT2AGLAMAPTRAB9A
SCHEMBL3769312 0.80 P2RX3 (0.50) TARBP2PDCD4RXFP1POLBKMT2A
SCHEMBL5192166 0.80 TARBP2 (0.75) TARBP2PDCD4POLBKMT2AMAPT
SCHEMBL14687788 0.79 KDM4E (0.43) POLBKMT2AMAPTRAB9ANPC1
SCHEMBL21878516 0.77 RAB9A (0.42) POLBKMT2AMAPTRAB9ANPC1
SCHEMBL29025968 0.76 TARBP2 (0.50) TARBP2PDCD4POLBGLAMAPT
SCHEMBL20502950 0.75 RAB9A (0.49) KMT2AMAPTRAB9ANPC1LMNA
SCHEMBL14687895 0.75 CYP4A11 (0.46) KMT2AMAPTRAB9ANPC1GAA
SCHEMBL28352443 0.74 RAB9A (0.40) POLBKMT2AMAPTRAB9ANPC1
SCHEMBL20502879 0.73 KDM4E (0.41) POLBKMT2AMAPTRAB9ANPC1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110770209-B Novel 5-hydroxypyridine compounds useful as P2X1 and P2X3 receptor antagonists and pharmaceutical compositions containing the same 光州科学技术院 2023-06-30 CN disclosed
CN-110770209-A Novel 5-hydroxypyridines as P2X1 and P2X3 receptor antagonists and pharmaceutical compositions containing the same 光州科学技术院 2020-02-07 CN disclosed