SCHEMBL26473033

SCHEMBL26473033

N#Cc1cccc(-c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc2-n2c3ccccc3c3ccc4oc5ccccc5c4c32)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 10/20 0.41
▸ CYP3A4 P08684 9/20 0.41
▸ CYP2D6 P10635 7/20 0.41
▸ ALDH1A1 P00352 6/20 0.41
▸ CLK4 Q9HAZ1 6/20 0.41
▸ MEN1 O00255 5/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ LMNA P02545 5/20 0.41
▸ CYP2C19 P33261 5/20 0.41
▸ HSD17B10 Q99714 5/20 0.41
▸ TSHR P16473 4/20 0.41
▸ CYP2C9 P11712 3/20 0.41
▸ MAPK1 P28482 4/20 0.39
▸ TP53 P04637 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ PGR P06401 1/20 0.37
▸ USP2 O75604 4/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ HIF1A Q16665 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
SCHEMBL26472482 0.93 TNKS (0.36) CYP1A2CYP3A4CYP2D6ALDH1A1CLK4
SCHEMBL26473031 0.90 CYP1A2 (0.40) CYP1A2CYP3A4CYP2D6ALDH1A1CLK4
SCHEMBL21089897 0.90 CYP1A2 (0.36) CYP1A2CYP3A4CYP2D6ALDH1A1CLK4
SCHEMBL26473152 0.89 CYP1A2 (0.41) CYP1A2CYP3A4CYP2D6ALDH1A1CLK4
SCHEMBL24224055 0.88 MAPT (0.33) ALDH1A1MEN1KMT2ALMNAHSD17B10
SCHEMBL22586858 0.87 CYP1A2 (0.39) CYP1A2CYP3A4CYP2D6ALDH1A1CLK4
SCHEMBL24025163 0.86 MAPT (0.32) ALDH1A1MEN1KMT2ALMNAHSD17B10
SCHEMBL26470957 0.86 NR3C1 (0.32) ALDH1A1KDM4E
SCHEMBL26471279 0.86 GABRP (0.35) CYP1A2ALDH1A1MEN1KMT2AMAPK1
SCHEMBL26471062 0.86 NR1I3 (0.36) CYP1A2CYP3A4ALDH1A1CLK4MEN1

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-20230127360-A1 ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2023-04-27 — — US disclosed
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