SCHEMBL21537568

SCHEMBL21537568

c1ccc(-c2ccc3ccc4ccc(-c5c6ccccc6c(-c6ccc(-c7nc8c9ccccc9c9ccccc9c8c8ccccc78)cc6)c6ccccc56)nc4c3n2)cc1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.35
ADORA2A P29274 1/20 0.31
NUDT1 P36639 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
RAB9A P51151 1/20 0.31
ATM Q13315 1/20 0.31
LMNA P02545 1/20 0.31
ESR1 P03372 2/20 0.30
ESR2 Q92731 2/20 0.30
MAP4K1 Q92918 1/20 0.30
AKT1 P31749 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
MAPK1 P28482 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL20352624 0.92 PARP1 (0.39) PARP1ADORA2ANUDT1MEN1KMT2A
SCHEMBL21537460 0.91 PARP1 (0.38) PARP1ADORA2ANUDT1MEN1KMT2A
SCHEMBL20352860 0.90 PARP1 (0.36) PARP1ADORA2AMEN1KMT2ARAB9A
SCHEMBL17915358 0.85 NUDT1 (0.39) ADORA2ANUDT1MEN1KMT2AATM
SCHEMBL21537567 0.85 PARP1 (0.35) PARP1ADORA2ANUDT1MEN1KMT2A
SCHEMBL21537459 0.85 PARP1 (0.37) PARP1KDM4E
SCHEMBL21537410 0.84 CYP1A1 (0.39) PARP1ADORA2AMEN1KMT2ARAB9A
SCHEMBL21537828 0.84 LMNA (0.38) PARP1ADORA2ANUDT1MEN1KMT2A
SCHEMBL21537559 0.84 PARP1 (0.34) PARP1ADORA2ANUDT1MEN1KMT2A
SCHEMBL20250448 0.83 PARP1 (0.43) PARP1MEN1KMT2ARAB9ALMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3561892-B1 ORGANIC LIGHT-EMITTING DEVICE LT MATERIALS CO LTD (KR) 2023-05-10 EP disclosed
US-11302873-B2 Organic light-emitting device LT MATERIALS CO, LTD. (KR) 2022-04-12 US disclosed
US-20200066996-A1 ORGANIC LIGHT-EMITTING DEVICE HEESUNG MATERIAL LTD. (KR) 2020-02-27 US disclosed
EP-3561892-A1 ORGANIC LIGHT-EMITTING DEVICE Heesung Material Ltd. (KR) 2019-10-30 EP disclosed