SCHEMBL16627801

SCHEMBL16627801

CN(c1ccc(Cl)cc1)c1cc2ccccc2[nH]c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.47
KDM4E B2RXH2 8/20 0.45
ALDH1A1 P00352 4/20 0.45
HPGD P15428 3/20 0.45
MAPT P10636 3/20 0.45
CYP1A2 P05177 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
CASP3 P42574 1/20 0.45
SENP8 Q96LD8 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
LMNA P02545 3/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
DAO P14920 1/20 0.44

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
SCHEMBL16627574 0.87 BRD4 (0.57) BRD4KDM4EALDH1A1MAPTCYP1A2
SCHEMBL16627800 0.86 BRD4 (0.47) BRD4KDM4EALDH1A1HPGDMAPT
SCHEMBL16627661 0.86 DAO (0.51) BRD4KDM4EALDH1A1CYP1A2MEN1
SCHEMBL16627578 0.86 BRD4 (0.47) BRD4KDM4EALDH1A1HPGDMAPT
SCHEMBL16627799 0.83 BRD4 (0.45) BRD4KDM4EALDH1A1HPGDMAPT
SCHEMBL16627651 0.82 BRD4 (0.44) BRD4KDM4EALDH1A1HPGDCYP1A2
SCHEMBL16627641 0.81 MEN1 (0.44) BRD4KDM4EALDH1A1MAPTCYP1A2
SCHEMBL30740090 0.71 KDM4E (0.60) BRD4KDM4EALDH1A1HPGDMAPT
SCHEMBL28599651 0.71 BRD4 (0.54) BRD4KDM4EALDH1A1HPGDMAPT
SCHEMBL11178624 0.71 KDM4E (0.60) BRD4KDM4EALDH1A1HPGDMAPT

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