SCHEMBL23768301

SCHEMBL23768301

CC(=O)NCCOCCOCCOCCN1C(=O)C=CC1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.62
MTNR1A P48039 5/20 0.41
MTNR1B P49286 5/20 0.41
SMN1; SMN2 Q16637 2/20 0.38
MAPK1 P28482 2/20 0.38
USP2 O75604 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
FAAH O00519 2/20 0.37
ALDH1A1 P00352 3/20 0.37
HPGD P15428 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
BLM P54132 1/20 0.37
WRN Q14191 1/20 0.37
HIF1A Q16665 1/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL19934141 0.87 MGLL (0.45) MGLLMTNR1AMTNR1BSMN1; SMN2MAPK1
SCHEMBL15381503 0.86 HPGD (0.45) MGLLSMN1; SMN2MAPK1FAAHALDH1A1
SCHEMBL15757532 0.86 MGLL (0.65) MGLLSMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL16095383 0.86 MGLL (0.65) MGLLSMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL27074376 0.86 MGLL (0.65) MGLLSMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL20690095 0.85 HTT (0.50) MGLLSMN1; SMN2MAPK1KMT2AFAAH
SCHEMBL16096276 0.84 MGLL (0.61) MGLLSMN1; SMN2MAPK1FAAHALDH1A1
SCHEMBL14878044 0.83 MGLL (0.41) MGLLMTNR1AMTNR1BSMN1; SMN2HSD17B10
SCHEMBL12617467 0.81 MGLL (0.54) MGLLALDH1A1
SCHEMBL30756675 0.81 MGLL (0.54) MGLLALDH1A1

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-20210255191-A1 FLUORESCENT DYE AND USE THEREOF EISAI R&D MANAGEMENT CO., LTD. (JP) 2021-08-19 US disclosed