SCHEMBL16627889

SCHEMBL16627889

C=C(CCCCc1ccccc1)c1cc2ccccc2n(CC)c1=O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
ADORA1 P30542 1/20 0.40
CNR1 P21554 6/20 0.40
CNR2 P34972 6/20 0.40
PLA2G4A P47712 1/20 0.39
CCR2 P41597 1/20 0.39
MAPT P10636 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
KDM4E B2RXH2 2/20 0.38
HPGD P15428 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 2/20 0.38
KMT2A Q03164 1/20 0.38
GSK3B P49841 1/20 0.38
ALOX15 P16050 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
HSD17B10 Q99714 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
SCHEMBL16627765 0.78 MAPK1 (0.47) L3MBTL1CNR1CNR2CCR2MAPT
SCHEMBL16627568 0.75 CA12 (0.51) L3MBTL1CNR1CNR2CCR2KDM4E
SCHEMBL6547150 0.72 MAPK1 (0.47) L3MBTL1CNR1CNR2CCR2KDM4E
SCHEMBL11824046 0.69 DAO (0.62) L3MBTL1CCR2MAPTKDM4EHPGD
SCHEMBL28325706 0.69 LMNA (0.48) CCR2MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL16627741 0.69 AHR (0.61) CNR1CNR2MAPTKMT2AHTT
SCHEMBL434663 0.68 KDM4E (0.50) CCR2KDM4EHPGDSMN1; SMN2LMNA
SCHEMBL11536101 0.67 CCR2 (0.66) CNR1CNR2CCR2KDM4EHPGD
SCHEMBL30884510 0.67 CCR2 (0.66) CNR1CNR2CCR2KDM4EHPGD
SCHEMBL16627569 0.66 CNR1 (0.60) CNR1CNR2CCR2MAPTKDM4E

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