SCHEMBL24929476

SCHEMBL24929476

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3sc3cccc(-c5cc(-c6ccc7sc8ccccc8c7c6)cc6sc7ccccc7c56)c34)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.39
LIMK1 P53667 3/20 0.34
PIM3 Q86V86 2/20 0.34
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
PIM1 P11309 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
CYP1A2 P05177 1/20 0.31
MAPT P10636 1/20 0.31
BRDT Q58F21 1/20 0.31
PARP14 Q460N5 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 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
SCHEMBL24929492 0.96 ALOX5 (0.41) ALOX5LIMK1PIM3TNKSTNKS2
SCHEMBL26226752 0.93 ALOX5 (0.39) ALOX5LIMK1TNKSTNKS2MAPT
SCHEMBL26235391 0.93 ALOX5 (0.39) ALOX5LIMK1TNKSTNKS2MAPT
SCHEMBL26216615 0.93 ALOX5 (0.39) ALOX5LIMK1PIM3TNKSTNKS2
SCHEMBL26216635 0.92 ALOX5 (0.37) ALOX5LIMK1TNKSTNKS2MAPT
SCHEMBL26763106 0.92 ALOX5 (0.39) ALOX5LIMK1PIM3PIM1PIM2
SCHEMBL26223490 0.91 ALOX5 (0.35) ALOX5LIMK1TNKSTNKS2BRDT
SCHEMBL24929937 0.91 PIM3 (0.35) ALOX5LIMK1PIM3CYP1A2MAPT
SCHEMBL26226677 0.91 ALOX5 (0.40) ALOX5LIMK1PIM3PIM1PIM2
SCHEMBL26763656 0.91 ALOX5 (0.40) ALOX5LIMK1PIM3PIM1PIM2

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
WO-2023008795-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER 엘티소재주식회사 2023-02-02 WO disclosed