SCHEMBL21573675

SCHEMBL21573675

c1ccc(-c2ccc3c4ccccc4n(-c4ccc5oc6cc7c(cc6c5c4)oc4cc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)ccc47)c3c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.34
ATM Q13315 2/20 0.34
KDM4E B2RXH2 2/20 0.34
MMP12 P39900 2/20 0.34
MMP13 P45452 1/20 0.34
PGR P06401 1/20 0.33
PLA2G2A P14555 1/20 0.33
PLA2G4A P47712 1/20 0.33
GAA P10253 1/20 0.33
CHEK2 O96017 1/20 0.32
PTGER4 P35408 1/20 0.32
HCRTR1 O43613 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
PRKDC P78527 1/20 0.32
HDAC4 P56524 1/20 0.31
AHR P35869 2/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL21669202 0.99 L3MBTL1 (0.35) L3MBTL1ATMKDM4EMMP12MMP13
SCHEMBL21883359 0.99 L3MBTL1 (0.35) L3MBTL1ATMKDM4EMMP12MMP13
SCHEMBL21883320 0.99 L3MBTL1 (0.35) L3MBTL1ATMKDM4EMMP12MMP13
SCHEMBL24216508 0.99 L3MBTL1 (0.35) L3MBTL1ATMKDM4EMMP12MMP13
SCHEMBL25926900 0.99 L3MBTL1 (0.35) L3MBTL1ATMKDM4EMMP12MMP13
SCHEMBL24216543 0.98 MMP12 (0.36) L3MBTL1ATMKDM4EMMP12MMP13
SCHEMBL24216424 0.97 PLA2G2A (0.37) L3MBTL1ATMKDM4EMMP12MMP13
SCHEMBL21668702 0.97 PLA2G2A (0.33) L3MBTL1ATMKDM4EMMP12MMP13
SCHEMBL21573697 0.97 PRKDC (0.33) L3MBTL1ATMKDM4EMMP12MMP13
SCHEMBL21668859 0.97 PLA2G2A (0.33) L3MBTL1ATMKDM4EMMP12MMP13

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
EP-3569603-A1 POLYCYCLIC COMPOUND, AND ORGANIC ELECTROLUMINESCENCE ELEMENT COMPRISING THE POLYCYCLIC COMPOUND Idemitsu Kosan Co., Ltd. (JP) 2019-11-20 EP disclosed