SCHEMBL28539802

SCHEMBL28539802

NC(=O)c1c(-c2ccccc2)ccc2cc3ccccc3cc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.51
ALDH1A1 P00352 5/20 0.51
GAA P10253 3/20 0.51
MEN1 O00255 6/20 0.44
KMT2A Q03164 6/20 0.44
HPGD P15428 3/20 0.44
HSD17B10 Q99714 2/20 0.44
CYP1A2 P05177 1/20 0.44
GLA P06280 1/20 0.44
CYP2C19 P33261 1/20 0.44
BCAT2 O15382 2/20 0.43
MAPT P10636 4/20 0.41
MPI P34949 1/20 0.41
MAPK1 P28482 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
RAB9A P51151 1/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
PARP1 P09874 1/20 0.38
GPR84 Q9NQS5 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
SCHEMBL8418459 0.87 KDM4E (0.56) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL722165 0.85 BCAT2 (0.47) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL9053835 0.79 BCAT2 (0.49) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL5747848 0.78 ALDH1A1 (0.56) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL10500899 0.78 KDM4E (0.66) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL31425004 0.78 KDM4E (0.66) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL28436566 0.77 ALDH1A1 (0.58) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL28421331 0.77 ALDH1A1 (0.58) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL29414557 0.77 ALDH1A1 (0.54) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL29203874 0.77 KDM4E (0.64) KDM4EALDH1A1GAAMEN1KMT2A

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-111233696-B Binamide derivative, preparation method thereof and application thereof in preparation of fluorescent material 吉林大学 2021-03-23 CN disclosed