SCHEMBL16627647

SCHEMBL16627647

O=c1[nH]c2ccccc2cc1Nc1ccc(O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.54
DDO Q99489 1/20 0.54
PRKD3 O94806 1/20 0.46
ABL1 P00519 1/20 0.46
EGFR P00533 1/20 0.46
PRKCG P05129 1/20 0.46
PRKCB P05771 1/20 0.46
SRC P12931 1/20 0.46
PRKCA P17252 1/20 0.46
PRKCH P24723 1/20 0.46
PRKCI P41743 1/20 0.46
ABL2 P42684 1/20 0.46
PRKCE Q02156 1/20 0.46
PRKCQ Q04759 1/20 0.46
PRKCZ Q05513 1/20 0.46
PRKCD Q05655 1/20 0.46
PRKD1 Q15139 1/20 0.46
BRD4 O60885 1/20 0.46
CDK5 Q00535 1/20 0.45
CDK5R1 Q15078 1/20 0.45

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
SCHEMBL16627639 0.87 PYGM (0.55) DAODDOPRKD3EGFRPRKCG
SCHEMBL16627732 0.85 DAO (0.55) DAODDOBRD4CHEK1KDR
SCHEMBL16627659 0.85 BRD4 (0.58) DAODDOEGFRBRD4CHEK1
SCHEMBL16627634 0.84 DAO (0.46) DAODDOBRD4CHEK1KDR
SCHEMBL16627640 0.84 BRD4 (0.45) DAODDOBRD4CHEK1KDR
SCHEMBL16627631 0.81 BRD4 (0.43) DAODDOBRD4CHEK1KDR
SCHEMBL16627633 0.81 BRD4 (0.46) DAODDOBRD4CHEK1KDR
SCHEMBL16627660 0.80 HPGD (0.50) BRD4GAAMAPTKDM4EMAPK1
SCHEMBL16627731 0.79 BRD4 (0.55) DAODDOBRD4CHEK1KDR
SCHEMBL486475 0.75 MAOB (0.56) DAODDOEGFRMEN1KMT2A

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