SCHEMBL16627809

SCHEMBL16627809

CCCNc1cc2ccccc2[nH]c1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.51
KDM4E B2RXH2 9/20 0.48
ALDH1A1 P00352 5/20 0.48
HPGD P15428 2/20 0.48
DAO P14920 1/20 0.47
DDO Q99489 1/20 0.47
DRD2 P14416 2/20 0.46
DRD3 P35462 1/20 0.46
CHEK1 O14757 1/20 0.45
KDR P35968 1/20 0.45
MAPT P10636 2/20 0.45
GAA P10253 1/20 0.45
HIF1A Q16665 1/20 0.45
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
MMP8 P22894 1/20 0.44
MMP13 P45452 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CYP1A2 P05177 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL7591960 0.90 MMP2 (0.50) BRD4KDM4EALDH1A1HPGDDAO
SCHEMBL16627856 0.87 BRD4 (0.54) BRD4KDM4EALDH1A1HPGDDAO
SCHEMBL16627797 0.81 BRD4 (0.47) BRD4KDM4EALDH1A1HPGDDAO
SCHEMBL16627871 0.80 KDM4E (0.47) BRD4KDM4EALDH1A1HPGDDAO
SCHEMBL5475933 0.80 ALDH1A1 (0.56) BRD4KDM4EALDH1A1HPGDDAO
SCHEMBL28100952 0.79 DAO (0.49) BRD4KDM4EALDH1A1HPGDDAO
SCHEMBL12909532 0.78 BRD4 (0.59) BRD4KDM4EALDH1A1HPGDDAO
SCHEMBL16627807 0.77 MEN1 (0.52) BRD4KDM4EALDH1A1HPGDDAO
SCHEMBL1772475 0.77 BRD4 (0.46) BRD4KDM4EALDH1A1HPGDDAO
SCHEMBL6253022 0.77 DRD2 (0.47) BRD4KDM4EALDH1A1HPGDDRD2

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
CN-112794818-A Preparation method of N-propylaminoquinolinone and application of N-propylaminoquinolinone in synthesis of abscisic acid agonist AM1 and derivatives thereof 邵阳学院 2021-05-14 CN claimed
CN-112794818-A Preparation method of N-propylaminoquinolinone and application of N-propylaminoquinolinone in synthesis of abscisic acid agonist AM1 and derivatives thereof 邵阳学院 2021-05-14 CN disclosed
WO-2015050379-A1 NOVEL QUINOLINONE DERIVATIVE AND USE THEREOF 광주과학기술원 2015-04-09 WO disclosed