SCHEMBL28608488

SCHEMBL28608488

O=C1CC(c2ccc(Br)cc2)Nc2ccc(Cl)cc21

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LIG1 P18858 2/20 0.51
MAPT P10636 3/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 2/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RECQL P46063 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.37
TGM2 P21980 1/20 0.37
CES1 P23141 1/20 0.37

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
SCHEMBL28612447 0.91 MEN1 (0.43) LIG1MAPTALDH1A1KDM4EMEN1
SCHEMBL28601603 0.87 MAPT (0.50) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL28610945 0.86 TGM2 (0.41) MAPTKDM4EMEN1KMT2AGLA
SCHEMBL28606032 0.85 GRIK1 (0.41) LIG1MEN1KMT2A
SCHEMBL28599139 0.84 GRIK1 (0.40) LIG1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL28614923 0.84 GRIK1 (0.40) LIG1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL28599093 0.83 LIG1 (0.39) LIG1MAPTALDH1A1KDM4EMEN1
SCHEMBL28603927 0.82 MAOB (0.43) MAPTPOLB
SCHEMBL28603953 0.80 KDM4E (0.48) MAPTKDM4E
SCHEMBL1501817 0.79 ALDH1A1 (0.51) MAPTALDH1A1KDM4ESMN1; SMN2MEN1

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
CN-108558756-B 2-aryl-2, 3-dihydro-4 (1H) -quinolinone semicarbazone compound and application thereof 沈阳药科大学 2021-08-03 CN claimed