SCHEMBL9470518

SCHEMBL9470518

CCCC(=O)c1ccc2[nH]c(=O)[se]c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 1/20 0.44
HPGD P15428 6/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
RAB9A P51151 3/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPT P10636 2/20 0.38
NPC1 O15118 3/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
PDE4D Q08499 4/20 0.36
PDE4A P27815 3/20 0.36
PDE4B Q07343 3/20 0.36
PDE4C Q08493 3/20 0.36
TLK2 Q86UE8 3/20 0.36
STS P08842 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36

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
SCHEMBL9469724 0.85 CYP1A2 (0.43) HPGDSMN1; SMN2L3MBTL1RAB9AALDH1A1
SCHEMBL6763737 0.75 MAPT (0.50) HSD17B3HPGDSMN1; SMN2L3MBTL1RAB9A
SCHEMBL9484788 0.73 ESR1 (0.48) HSD17B3HPGDSMN1; SMN2L3MBTL1MAPT
SCHEMBL12266541 0.71 ALDH1A1 (0.69) HSD17B3HPGDALDH1A1MAPTMEN1
SCHEMBL10803052 0.71 KDM4E (0.50) HSD17B3HPGDSMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL9470120 0.71 HSD17B3 (0.44) HSD17B3HPGDSMN1; SMN2L3MBTL1RAB9A
SCHEMBL17297936 0.70 KDM4E (0.47) HSD17B3HPGDSMN1; SMN2L3MBTL1RAB9A
SCHEMBL26254861 0.69 HSD17B3 (0.82) HSD17B3HPGDSMN1; SMN2L3MBTL1RAB9A
SCHEMBL11293674 0.69 NPSR1 (0.51) HSD17B3HPGDSMN1; SMN2L3MBTL1RAB9A
SCHEMBL26958041 0.68 HSD17B3 (0.61) HSD17B3HPGDSMN1; SMN2L3MBTL1RAB9A

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
US-5246951-A Nonsteroidal antiinflammatory agents ADIR ET COMPAGNIE (FR) 1993-09-21 US disclosed
EP-0487423-A1 Benzoselenazolinone derivatives, their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1992-05-27 EP disclosed