SCHEMBL28574227

SCHEMBL28574227

CCOP(=O)(OCC)OCc1ccc(-c2nnc(-c3cccs3)o2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 12/20 0.61
HPGD P15428 12/20 0.61
ALDH1A1 P00352 11/20 0.61
RAB9A P51151 10/20 0.61
SMN1; SMN2 Q16637 9/20 0.61
NPC1 O15118 7/20 0.61
MAPT P10636 3/20 0.61
TP53 P04637 4/20 0.56
NFKB1 P19838 2/20 0.55
NFKB2 Q00653 2/20 0.55
RELA Q04206 2/20 0.55
HSD17B10 Q99714 7/20 0.55
GAA P10253 2/20 0.52
MEN1 O00255 1/20 0.52
HCRTR1 O43613 1/20 0.52
CASP3 P42574 1/20 0.52
KMT2A Q03164 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
RXFP1 Q9HBX9 1/20 0.52
MAPK1 P28482 1/20 0.49

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
SCHEMBL10247599 0.73 HPGD (0.53) KDM4EHPGDALDH1A1RAB9ASMN1; SMN2
SCHEMBL13930785 0.72 ALDH1A1 (1.00) KDM4EHPGDALDH1A1RAB9ASMN1; SMN2
SCHEMBL28830383 0.71 TSHR (0.59) GAAMEN1KMT2ACA1CA2
SCHEMBL4369594 0.71 TSHR (0.45) KDM4EHPGDALDH1A1RAB9ASMN1; SMN2
SCHEMBL12171933 0.71 RAB9A (0.67) KDM4EHPGDALDH1A1RAB9ASMN1; SMN2
SCHEMBL4879939 0.70 KDM4E (0.73) KDM4EHPGDALDH1A1RAB9ASMN1; SMN2
SCHEMBL7059841 0.70 ALDH1A1 (0.73) KDM4EHPGDALDH1A1RAB9ASMN1; SMN2
SCHEMBL13762461 0.70 KDM4E (0.70) KDM4EHPGDALDH1A1RAB9ASMN1; SMN2
SCHEMBL720619 0.70 RAB9A (0.71) KDM4EHPGDALDH1A1RAB9ASMN1; SMN2
SCHEMBL13930781 0.70 ALDH1A1 (0.71) KDM4EHPGDALDH1A1RAB9ASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108314679-B Bactericide containing 1,3, 4-oxadiazole ring stilbene amide and preparation method and application thereof 华南理工大学 2021-06-08 CN claimed
CN-108558850-B Bactericide containing thiophene ring and stilbene amide, and preparation method and application thereof 华南理工大学 2021-06-08 CN claimed