SCHEMBL16627872

SCHEMBL16627872

O=c1[nH]c2ccccc2cc1NCc1ccc(F)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.52
KDM4E B2RXH2 4/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ALDH1A1 P00352 3/20 0.44
HPGD P15428 1/20 0.44
BRD4 O60885 1/20 0.43
DAO P14920 1/20 0.43
DDO Q99489 1/20 0.43
MAPT P10636 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
POLB P06746 1/20 0.43
CDC25B P30305 1/20 0.42
GAA P10253 1/20 0.41
HIF1A Q16665 1/20 0.41
LMNA P02545 1/20 0.41
CHEK1 O14757 1/20 0.41

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
SCHEMBL16627870 0.86 DRD2 (0.45) CNR1KDM4EMEN1KMT2AALDH1A1
SCHEMBL16627873 0.86 IDH1 (0.46) KDM4EMEN1KMT2AALDH1A1HPGD
SCHEMBL16627871 0.86 KDM4E (0.47) CNR1KDM4EALDH1A1HPGDBRD4
SCHEMBL16627733 0.84 MAPT (0.45) KDM4EMEN1KMT2AALDH1A1HPGD
SCHEMBL16627734 0.77 MEN1 (0.58) KDM4EMEN1KMT2AALDH1A1HPGD
SCHEMBL16627711 0.76 HTT (0.57) CNR1KDM4EMEN1KMT2AHSD17B10
SCHEMBL16627856 0.76 BRD4 (0.54) KDM4EHSD17B10ALDH1A1HPGDBRD4
SCHEMBL23657552 0.74 KDM4E (0.53) KDM4EMEN1KMT2AHSD17B10ALDH1A1
SCHEMBL13726248 0.74 STK33 (0.65) KDM4EMEN1KMT2AALDH1A1MAPT
SCHEMBL16627809 0.74 BRD4 (0.51) KDM4EHSD17B10ALDH1A1HPGDBRD4

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
WO-2015050379-A1 NOVEL QUINOLINONE DERIVATIVE AND USE THEREOF 광주과학기술원 2015-04-09 WO disclosed