SCHEMBL24329142

SCHEMBL24329142

Cc1ccc(/C=C/C(=O)c2c(O)n(C)c(=O)n(C)c2=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC5A1 P13866 1/20 0.54
SLC5A2 P31639 1/20 0.54
MAPT P10636 6/20 0.50
MAOA P21397 5/20 0.49
MAOB P27338 5/20 0.49
POLB P06746 1/20 0.49
RAB9A P51151 1/20 0.49
LMNA P02545 2/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
HSD17B10 Q99714 1/20 0.48
PADI4 Q9UM07 2/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP3A4 P08684 1/20 0.47
HPGD P15428 1/20 0.47
FOS P01100 1/20 0.44
JUN P05412 1/20 0.44
CYP1B1 Q16678 1/20 0.43

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
SCHEMBL24329120 0.88 MAPT (0.47) SLC5A1SLC5A2MAPTRAB9ALMNA
SCHEMBL29564507 0.87 MAPT (0.60) SLC5A1SLC5A2MAPTMAOAMAOB
SCHEMBL29564436 0.80 THRA (0.43)
SCHEMBL29564482 0.80 THRA (0.43)
SCHEMBL25185006 0.72 MAPT (0.65) SLC5A1SLC5A2MAPTMAOAMAOB
SCHEMBL25218105 0.70 SLC5A1 (1.00) SLC5A1SLC5A2MAPTMAOAMAOB
SCHEMBL29564529 0.70 HPGD (0.47) MAPTMAOBPOLBRAB9ALMNA
SCHEMBL5598705 0.69 JUN (0.74) SLC5A1SLC5A2MAPTMAOAMAOB
SCHEMBL5598702 0.69 JUN (0.74) SLC5A1SLC5A2MAPTMAOAMAOB
SCHEMBL29564434 0.69 MAPT (0.49) SLC5A1SLC5A2MAPTMAOAMAOB

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-2022080346-A1 NOVEL NITROGEN-CONTAINING CYCLIC COMPOUND AND APPLICATION THEREOF 国立大学法人佐賀大学 2022-04-21 WO disclosed