SCHEMBL22457286

SCHEMBL22457286

Ic1ccccc1-n1c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2c2cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ ATM Q13315 1/20 0.53
▸ ALDH1A1 P00352 2/20 0.40
▸ PTGER4 P35408 1/20 0.36
▸ KMT2A Q03164 2/20 0.35
▸ IL1R1 P14778 1/20 0.35
▸ TSPO P30536 1/20 0.35
▸ HDAC4 P56524 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ JAK2 O60674 1/20 0.34
▸ JAK3 P52333 1/20 0.34
▸ EDNRB P24530 1/20 0.33
▸ EDNRA P25101 1/20 0.33
▸ PTPN1 P18031 1/20 0.33
▸ AKR1C4 P17516 1/20 0.33
▸ AKR1C3 P42330 1/20 0.33

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
SCHEMBL17810117 0.96 L3MBTL1 (0.49) L3MBTL1KDM4EATMALDH1A1PTGER4
SCHEMBL25557692 0.89 L3MBTL1 (0.62) L3MBTL1KDM4EATMALDH1A1PTGER4
SCHEMBL29354385 0.86 L3MBTL1 (0.72) L3MBTL1KDM4EATMALDH1A1PTGER4
SCHEMBL11981026 0.86 L3MBTL1 (0.72) L3MBTL1KDM4EATMALDH1A1PTGER4
SCHEMBL29387946 0.86 L3MBTL1 (0.72) L3MBTL1KDM4EATMALDH1A1PTGER4
SCHEMBL29431010 0.86 L3MBTL1 (0.72) L3MBTL1KDM4EATMALDH1A1PTGER4
SCHEMBL11981068 0.86 L3MBTL1 (0.72) L3MBTL1KDM4EATMALDH1A1PTGER4
SCHEMBL5999723 0.86 L3MBTL1 (0.72) L3MBTL1KDM4EATMALDH1A1PTGER4
SCHEMBL14900748 0.86 L3MBTL1 (0.72) L3MBTL1KDM4EATMALDH1A1PTGER4
SCHEMBL26241842 0.85 L3MBTL1 (0.46) L3MBTL1KDM4EATMALDH1A1PTGER4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3820966-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2022-06-08 — — EP disclosed
WO-2020187865-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-09-24 — — WO disclosed
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