SCHEMBL21972496

SCHEMBL21972496

c1ccc(N(c2ccccc2)c2cccc(-c3ccc(N(c4ccc(-c5ccc(-c6cccc7ccccc67)cc5)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.47
▸ CA12 O43570 2/20 0.41
▸ CA1 P00915 2/20 0.41
▸ CA2 P00918 2/20 0.41
▸ CA9 Q16790 2/20 0.41
▸ GGPS1 O95749 1/20 0.39
▸ PRKDC P78527 2/20 0.36
▸ MCL1 Q07820 1/20 0.36
▸ ACMSD Q8TDX5 1/20 0.36
▸ PTGES2 Q9H7Z7 1/20 0.36
▸ PLA2G2A P14555 2/20 0.34
▸ PLA2G4A P47712 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ HPGD P15428 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ ENPP3 O14638 1/20 0.34
▸ ENPP1 P22413 1/20 0.34
▸ GAA P10253 1/20 0.34

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
SCHEMBL22431987 1.00 ALOX5 (0.47) ALOX5CA12CA1CA2CA9
SCHEMBL10110379 1.00 ALOX5 (0.47) ALOX5CA12CA1CA2CA9
SCHEMBL18854416 1.00 ALOX5 (0.47) ALOX5CA12CA1CA2CA9
SCHEMBL24919255 0.99 ALOX5 (0.49) ALOX5CA12CA1CA2CA9
SCHEMBL10110380 0.99 ALOX5 (0.46) ALOX5CA12CA1CA2CA9
SCHEMBL23056807 0.99 ALOX5 (0.48) ALOX5CA12CA1CA2CA9
SCHEMBL22757062 0.99 ALOX5 (0.48) ALOX5CA12CA1CA2CA9
SCHEMBL23238862 0.98 ALOX5 (0.48) ALOX5CA12CA1CA2CA9
SCHEMBL23224509 0.98 ALOX5 (0.48) ALOX5CA12CA1CA2CA9
SCHEMBL23237220 0.98 ALOX5 (0.48) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11744145-B2 Organic compound and organic electroluminescent device comprising the same LG DISPLAY CO., LTD. (KR) 2023-08-29 — — US disclosed
US-11744145-B2 Organic compound and organic electroluminescent device comprising the same LG DISPLAY CO., LTD. (KR) 2023-08-29 — — US disclosed
US-20200144506-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME MATERIAL SCIENCE CO., LTD. (KR) 2020-05-07 — — US disclosed
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