SCHEMBL30450198

SCHEMBL30450198

Brc1c2ccccc2c(-c2ccc3ccc4ccc(-c5ccccc5)nc4c3n2)c2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.42
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
RAB9A P51151 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ASIC3 Q9UHC3 1/20 0.34
ACHE P22303 1/20 0.34
MKNK2 Q9HBH9 1/20 0.34
GAK O14976 1/20 0.34
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
LIMK1 P53667 1/20 0.33
ALDH1A1 P00352 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
RECQL P46063 1/20 0.33

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
SCHEMBL21518524 1.00 PARP1 (0.42) PARP1MAPTKDM4EMAPK1TDP1
SCHEMBL20250399 0.88 PARP1 (0.45) PARP1MAPTKDM4EMAPK1TDP1
SCHEMBL20250448 0.85 PARP1 (0.43) PARP1MAPTKDM4EMAPK1TDP1
SCHEMBL19253886 0.84 MEN1 (0.59) MAPTKDM4EMAPK1TDP1L3MBTL1
SCHEMBL22042804 0.84 CCR1 (0.43) PARP1MAPTKDM4EMAPK1TDP1
SCHEMBL20250514 0.83 KMT2A (0.45) PARP1MAPTKDM4EL3MBTL1RAB9A
SCHEMBL20250457 0.82 PARP1 (0.46) PARP1MAPTKDM4EMAPK1TDP1
SCHEMBL20250438 0.82 PARP1 (0.41) PARP1MAPTKDM4ERAB9AMEN1
SCHEMBL20250544 0.82 MEN1 (0.42) PARP1MAPTKDM4ETDP1L3MBTL1
SCHEMBL20250402 0.82 PARP1 (0.44) PARP1RAB9AMEN1KMT2AACHE

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
CN-110121794-B Organic light emitting device LT素材株式会社 2023-04-04 CN disclosed