SCHEMBL28731038

SCHEMBL28731038

CCN(CC)c1ccc2cc(C(C)=O)c(=O)oc2c1.CCN(CC)c1ccc2cc(C=O)c(=O)oc2c1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.82
MAPT P10636 8/20 0.82
KMT2A Q03164 8/20 0.82
MAOB P27338 3/20 0.82
ATM Q13315 3/20 0.82
USP2 O75604 2/20 0.82
CYP1A2 P05177 1/20 0.82
CYP2C19 P33261 1/20 0.82
KDM4E B2RXH2 7/20 0.80
ALDH1A1 P00352 6/20 0.80
HPGD P15428 4/20 0.80
NPSR1 Q6W5P4 2/20 0.80
SMN1; SMN2 Q16637 3/20 0.67
HSD17B10 Q99714 2/20 0.67
SLC16A3 O15427 2/20 0.67
ALOX15 P16050 1/20 0.67
SLC16A1 P53985 1/20 0.67
CYP19A1 P11511 1/20 0.56
NPC1 O15118 1/20 0.53
STAT3 P40763 1/20 0.53

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
SCHEMBL1131018 0.91 MEN1 (1.00) MEN1MAPTKMT2AMAOBATM
SCHEMBL29460450 0.91 MEN1 (1.00) MEN1MAPTKMT2AMAOBATM
SCHEMBL30195208 0.89 MEN1 (1.00) MEN1MAPTKMT2AMAOBATM
SCHEMBL61603 0.89 MEN1 (1.00) MEN1MAPTKMT2AMAOBATM
SCHEMBL23782005 0.88 MEN1 (0.97) MEN1MAPTKMT2AMAOBATM
SCHEMBL29275428 0.84 MEN1 (0.80) MEN1MAPTKMT2AMAOBATM
SCHEMBL61629 0.82 MEN1 (0.81) MEN1MAPTKMT2AMAOBATM
SCHEMBL11627303 0.82 KMT2A (0.72) MEN1MAPTKMT2AMAOBATM
Acetone SCHEMBL15015702 0.82 MEN1 (0.82) MEN1MAPTKMT2AMAOBATM
SCHEMBL51872 0.81 MEN1 (0.82) MEN1MAPTKMT2AMAOBATM

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
CN-114345250-B Preparation method of biosensor based on polystyrene microspheres 深圳技术大学 2023-03-24 CN disclosed
CN-114345250-A Preparation method of biosensor based on polystyrene microspheres 深圳技术大学 2022-04-15 CN disclosed