SCHEMBL29324197

SCHEMBL29324197

c1ccc2c(c1)ccc1c3cccc(Nc4ccc5c(c4)oc4ccccc45)c3sc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DUSP3 P51452 1/20 0.53
FADS1 O60427 1/20 0.42
KMT2A Q03164 7/20 0.40
MEN1 O00255 6/20 0.40
SMN1; SMN2 Q16637 6/20 0.40
NPC1 O15118 5/20 0.40
RAB9A P51151 5/20 0.40
GAA P10253 4/20 0.40
MAPK14 Q16539 1/20 0.40
HPGD P15428 5/20 0.39
ALDH1A1 P00352 5/20 0.39
KDM4E B2RXH2 4/20 0.39
MAPT P10636 3/20 0.39
LMNA P02545 2/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 3/20 0.38
TP53 P04637 3/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TSHR P16473 2/20 0.38
CYP3A4 P08684 1/20 0.38

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
SCHEMBL29324207 0.95 DUSP3 (0.47) DUSP3FADS1KMT2AMEN1SMN1; SMN2
SCHEMBL17742393 0.85 DUSP3 (0.46) DUSP3KMT2AMEN1SMN1; SMN2NPC1
SCHEMBL17383282 0.84 MAPK14 (0.51) FADS1KMT2AMEN1NPC1RAB9A
SCHEMBL14295754 0.84 DUSP3 (0.67) DUSP3FADS1KMT2AMEN1SMN1; SMN2
SCHEMBL23637473 0.81 DUSP3 (0.45) DUSP3FADS1KMT2AMEN1SMN1; SMN2
SCHEMBL22891770 0.80 ALDH1A1 (0.61) FADS1KMT2AMEN1SMN1; SMN2NPC1
SCHEMBL25606952 0.80 DUSP3 (0.55) DUSP3FADS1KMT2AMEN1SMN1; SMN2
SCHEMBL23637467 0.80 MAPK14 (0.41) FADS1SMN1; SMN2NPC1RAB9AMAPK14
SCHEMBL14295752 0.78 FADS1 (0.58) DUSP3FADS1KMT2AMEN1SMN1; SMN2
SCHEMBL17383283 0.78 CYP1A1 (0.48) FADS1KMT2AMEN1NPC1RAB9A

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
US-20240244860-A1 LIGHT EMITTING ELEMENT AND AMINE COMPOUND FOR THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2024-07-18 US disclosed