SCHEMBL24826546

SCHEMBL24826546

c1ccc2c(-c3ccc(N(c4ccc(-c5ccc6c(ccc7ccccc76)c5)cc4)c4cccc5ccc6c7ccccc7oc6c45)cc3)cccc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.38
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
ERBB2 P04626 1/20 0.32
CYP1A2 P05177 1/20 0.32
FYN P06241 1/20 0.32
MAOA P21397 1/20 0.32
ACHE P22303 1/20 0.32
AHR P35869 1/20 0.32
PRKDC P78527 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ENPP3 O14638 1/20 0.31
ENPP1 P22413 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL24825630 0.95 ALOX5 (0.39) ALOX5CA12CA1CA2CA9
SCHEMBL24826551 0.94 ALOX5 (0.38) ALOX5CA12CA1CA2CA9
SCHEMBL24825634 0.94 ALOX5 (0.40) ALOX5CA12CA1CA2CA9
SCHEMBL24825627 0.93 ALOX5 (0.38) ALOX5CA12CA1CA2CA9
SCHEMBL24888200 0.92 ALOX5 (0.37) ALOX5CA12CA1CA2CA9
SCHEMBL24825636 0.92 ALOX5 (0.37) ALOX5CA12CA1CA2CA9
SCHEMBL24657358 0.92 ALOX5 (0.38) ALOX5CA12CA1CA2CA9
SCHEMBL24825968 0.92 ALOX5 (0.39) ALOX5CA12CA1CA2CA9
SCHEMBL26057100 0.92 ALOX5 (0.39) ALOX5CA12CA1CA2CA9
SCHEMBL24887385 0.91 ALOX5 (0.38) ALOX5CA12CA1CA2CA9

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
US-20220416174-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2022-12-29 US disclosed