SCHEMBL26499340

SCHEMBL26499340

c1ccc(-c2cccc(-c3cccc(-c4cccc(-c5cccc(-c6ccc(-c7cccc(-c8ccccn8)c7)cc6)c5)c4)c3)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.52
LMNA P02545 4/20 0.52
CCR1 P32246 2/20 0.52
CCR5 P51681 2/20 0.52
CCR8 P51685 2/20 0.52
CYP1A2 P05177 1/20 0.52
POLB P06746 1/20 0.52
METAP1 P53582 1/20 0.52
BLM P54132 1/20 0.52
HIF1A Q16665 1/20 0.52
DOHH Q9BU89 1/20 0.52
P4HTM Q9NXG6 1/20 0.52
CYP2A6 P11509 1/20 0.52
TP53 P04637 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
ALOX15 P16050 2/20 0.50
HTT P42858 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
ALDH1A1 P00352 2/20 0.50

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
SCHEMBL14425486 1.00 KDM4E (0.52) KDM4ELMNACCR1CCR5CCR8
SCHEMBL13799178 0.98 KDM4E (0.54) KDM4ELMNACCR1CCR5CCR8
SCHEMBL26499031 0.98 KDM4E (0.54) KDM4ELMNACCR1CCR5CCR8
SCHEMBL30088399 0.98 KDM4E (0.54) KDM4ELMNACCR1CCR5CCR8
SCHEMBL650000 0.98 KDM4E (0.54) KDM4ELMNACCR1CCR5CCR8
SCHEMBL24492797 0.96 KDM4E (0.52) KDM4ELMNACCR1CCR5CCR8
SCHEMBL14425485 0.96 LMNA (0.52) KDM4ELMNACCR1CCR5CCR8
SCHEMBL2188788 0.96 KDM4E (0.52) KDM4ELMNACCR1CCR5CCR8
SCHEMBL21334236 0.96 KDM4E (0.52) KDM4ELMNACCR1CCR5CCR8
SCHEMBL27842924 0.96 KDM4E (0.52) KDM4ELMNACCR1CCR5CCR8

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-2023182184-A1 LIGHT-EMITTING LAYER COMPOSITION, ORGANIC ELECTROLUMINESCENT ELEMENT, AND PRODUCTION METHOD THEREFOR 三菱ケミカル株式会社 2023-09-28 WO disclosed