SCHEMBL7837528

SCHEMBL7837528

O=C1CN(c2ccccc2)C(=O)N1C(=O)c1ccc2ccccc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.53
LMNA P02545 2/20 0.53
NPC1 O15118 4/20 0.52
RAB9A P51151 4/20 0.52
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.50
BCHE P06276 1/20 0.48
HPGD P15428 1/20 0.46
AKR1C1 Q04828 1/20 0.45
CTSG P08311 2/20 0.44
CMA1 P23946 2/20 0.44
USP2 O75604 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
ALOX15 P16050 1/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CES2 O00748 1/20 0.44

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
SCHEMBL7826151 0.84 NPC1 (0.71) NPC1RAB9AKMT2AMEN1CTSG
SCHEMBL7836895 0.82 KMT2A (0.51) TSHRNPC1RAB9AKMT2AMEN1
SCHEMBL7836516 0.81 KMT2A (0.60) NPC1RAB9AKMT2AMEN1HPGD
SCHEMBL7837470 0.80 CTSG (0.53) NPC1RAB9AKMT2AMEN1CTSG
SCHEMBL7838574 0.80 KMT2A (0.58) LMNANPC1RAB9AKMT2AMEN1
SCHEMBL7837364 0.80 KMT2A (0.55) TSHRNPC1RAB9AKMT2AMEN1
SCHEMBL7833371 0.79 CTSG (0.54) TSHRLMNANPC1RAB9AKMT2A
SCHEMBL11577852 0.77 BCHE (0.56) TSHRLMNANPC1RAB9AKMT2A
SCHEMBL7823718 0.75 BCHE (0.48) LMNANPC1RAB9AKMT2AMEN1
SCHEMBL921684 0.72 NPC1 (0.51) NPC1RAB9AKMT2AMEN1CTSG

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0721944-B1 IMIDAZOLIDINE DERIVATIVE AND USE THEREOF SUNTORY LTD (JP) 2001-01-17 EP disclosed
US-5691335-A CARDIOVASCULAR DISORDERS SUNTORY LIMITED (JP) 1997-11-25 US disclosed
EP-0721944-A1 IMIDAZOLIDINE DERIVATIVE AND USE THEREOF SUNTORY LIMITED (JP) 1996-07-17 EP disclosed