SCHEMBL21573697

SCHEMBL21573697

c1ccc(-c2ccc3c4ccccc4n(-c4ccc5oc6cc7oc8cc(-c9nc(-c%10ccccc%10)nc(-c%10ccccc%10)n9)ccc8c7cc6c5c4)c3c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 3/20 0.33
ATM Q13315 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MMP12 P39900 2/20 0.33
MMP13 P45452 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PGR P06401 1/20 0.33
PLA2G2A P14555 1/20 0.32
PLA2G4A P47712 1/20 0.32
GAA P10253 1/20 0.32
CHEK2 O96017 1/20 0.32
PTGER4 P35408 1/20 0.32
HCRTR1 O43613 1/20 0.32
MAOA P21397 1/20 0.31
HDAC4 P56524 1/20 0.31
SIRT2 Q8IXJ6 1/20 0.30
SIRT1 Q96EB6 1/20 0.30

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
SCHEMBL21883320 0.98 L3MBTL1 (0.35) PRKDCATML3MBTL1MMP12MMP13
SCHEMBL21883359 0.98 L3MBTL1 (0.35) PRKDCATML3MBTL1MMP12MMP13
SCHEMBL24216508 0.98 L3MBTL1 (0.35) PRKDCATML3MBTL1MMP12MMP13
SCHEMBL21669202 0.98 L3MBTL1 (0.35) PRKDCATML3MBTL1MMP12MMP13
SCHEMBL25926900 0.98 L3MBTL1 (0.35) PRKDCATML3MBTL1MMP12MMP13
SCHEMBL24216543 0.97 MMP12 (0.36) PRKDCATML3MBTL1MMP12MMP13
SCHEMBL21573675 0.97 L3MBTL1 (0.34) PRKDCATML3MBTL1MMP12MMP13
SCHEMBL24216424 0.96 PLA2G2A (0.37) ATML3MBTL1MMP12MMP13KDM4E
SCHEMBL21573629 0.96 PLA2G2A (0.34) PRKDCATML3MBTL1MMP12MMP13
SCHEMBL21668859 0.96 PLA2G2A (0.33) PRKDCATML3MBTL1MMP12MMP13

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