SCHEMBL29507013

SCHEMBL29507013

O=c1nc(-c2ccccc2)nc2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)cn12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ PTGER4 P35408 1/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ PTPN1 P18031 1/20 0.33
▸ TSPO P30536 1/20 0.33
▸ HDAC4 P56524 1/20 0.33
▸ RXRA P19793 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32
▸ TSHR P16473 3/20 0.32
▸ LMNA P02545 2/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ NPY5R Q15761 1/20 0.31
▸ MAT2A P31153 2/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ PRMT5 O14744 1/20 0.31
▸ HSP90AA1 P07900 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
SCHEMBL23076044 1.00 KDM4E (0.39) KDM4EATML3MBTL1PTGER4KMT2A
SCHEMBL23076199 0.97 TSPO (0.35) KDM4EATML3MBTL1PTGER4KMT2A
SCHEMBL23076281 0.91 KDM4E (0.41) KDM4EATML3MBTL1PTGER4KMT2A
SCHEMBL23076042 0.88 KDM4E (0.40) KDM4EATML3MBTL1PTGER4KMT2A
SCHEMBL23076040 0.87 KMT2A (0.39) KDM4EATML3MBTL1KMT2APTPN1
SCHEMBL24663195 0.83 PTGER4 (0.32) KDM4EATML3MBTL1PTGER4KMT2A
SCHEMBL23959262 0.82 AKT1 (0.42) KDM4EATML3MBTL1
SCHEMBL6374181 0.82 L3MBTL1 (0.55) KDM4EATML3MBTL1PTGER4KMT2A
SCHEMBL15371723 0.82 L3MBTL1 (0.55) KDM4EATML3MBTL1PTGER4KMT2A
SCHEMBL29358983 0.82 L3MBTL1 (0.55) KDM4EATML3MBTL1PTGER4KMT2A

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-4025566-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmbH (DE) 2022-07-13 — — EP disclosed
CN-114341117-A Material for organic electroluminescent device 默克专利有限公司 2022-04-12 — — CN disclosed
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