SCHEMBL28454548

SCHEMBL28454548

CCCCc1ccc(Nc2cccc3nsnc23)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.44
▸ L3MBTL1 Q9Y468 3/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ MAPT P10636 7/20 0.41
▸ MEN1 O00255 6/20 0.41
▸ KMT2A Q03164 6/20 0.41
▸ NPC1 O15118 3/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ NPSR1 Q6W5P4 3/20 0.41
▸ ALDH1A1 P00352 5/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ HPGD P15428 2/20 0.41
▸ CASP3 P42574 1/20 0.41
▸ SENP8 Q96LD8 1/20 0.41
▸ SENP7 Q9BQF6 1/20 0.41
▸ SENP6 Q9GZR1 1/20 0.41
▸ BACE1 P56817 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ HSD17B10 Q99714 2/20 0.39

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
SCHEMBL14127780 0.76 HPGD (0.49) L3MBTL1MAPK1MAPTMEN1KMT2A
SCHEMBL1031878 0.71 KMT2A (0.49) L3MBTL1MAPK1MAPTMEN1KMT2A
SCHEMBL48879 0.71 HPGD (0.58) L3MBTL1MAPK1MAPTMEN1KMT2A
SCHEMBL14127779 0.71 HPGD (0.58) L3MBTL1MAPK1MAPTMEN1KMT2A
SCHEMBL28857667 0.71 HPGD (0.57) KDM4EL3MBTL1TDP1MAPTMEN1
SCHEMBL12471994 0.70 MEN1 (0.49) KDM4EL3MBTL1MAPK1TDP1MAPT
SCHEMBL8750639 0.70 BACE1 (0.44) L3MBTL1MAPK1TDP1MAPTMEN1
SCHEMBL27619358 0.70 MAPT (0.57) KDM4EL3MBTL1MAPK1TDP1MAPT
SCHEMBL17616985 0.70 UNG (0.48) KDM4ETDP1MAPTMEN1KMT2A
SCHEMBL9274463 0.69 HPGD (0.50) L3MBTL1MAPK1MAPTMEN1KMT2A

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
CN-111662439-A Blue-light organic electroluminescent material and preparation method thereof 朱成杰 2020-09-15 — — CN claimed
CN-111662439-A Blue-light organic electroluminescent material and preparation method thereof 朱成杰 2020-09-15 — — CN disclosed
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