SCHEMBL25720786

SCHEMBL25720786

c1ccc(-c2ccc3c(c2)-c2cccc(-c4cccc5c4Cc4cc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)ccc4-5)c2C3)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 5/20 0.41
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
MEN1 O00255 4/20 0.37
MAPT P10636 4/20 0.37
KMT2A Q03164 4/20 0.37
LMNA P02545 2/20 0.37
APAF1 O14727 1/20 0.37
NPC1 O15118 1/20 0.37
THRB P10828 1/20 0.37
XBP1 P17861 1/20 0.37
PTBP1 P26599 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
GALK1 P51570 1/20 0.37
BLM P54132 1/20 0.37
SMAD3 P84022 1/20 0.37
ATM Q13315 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL17467372 0.92 ADORA2A (0.38) TDP2ADORA2AADORA1MEN1MAPT
SCHEMBL17467371 0.92 ADORA2A (0.38) TDP2ADORA2AADORA1MEN1MAPT
SCHEMBL17467369 0.92 ADORA2A (0.38) TDP2ADORA2AADORA1MEN1MAPT
SCHEMBL17467370 0.92 ADORA2A (0.39) TDP2ADORA2AADORA1MEN1MAPT
SCHEMBL17467362 0.92 ADORA2A (0.39) TDP2ADORA2AADORA1MEN1MAPT
SCHEMBL17467364 0.92 ADORA2A (0.39) TDP2ADORA2AADORA1MEN1MAPT
SCHEMBL17467365 0.90 ADORA2A (0.38) TDP2ADORA2AADORA1MEN1MAPT
SCHEMBL17467361 0.90 ADORA2A (0.38) TDP2ADORA2AADORA1MEN1MAPT
SCHEMBL17467368 0.90 ADORA2A (0.40) ADORA2AADORA1MEN1MAPTKMT2A
SCHEMBL25720715 0.89 MEN1 (0.38) TDP2ADORA2AADORA1MEN1MAPT

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-4190779-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT-EMITTING DEVICE LT Materials Co., Ltd. (KR) 2023-06-07 EP disclosed