SCHEMBL27372805

SCHEMBL27372805

COc1ccc(OC)c(C(=O)Nc2ccc(NC(=O)c3cccc4ccccc34)cc2)c1

nearest known ligand 0.79

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 10/20 0.67
▸ MEN1 O00255 9/20 0.67
▸ NPC1 O15118 6/20 0.67
▸ RAB9A P51151 5/20 0.64
▸ POLB P06746 3/20 0.62
▸ AHR P35869 3/20 0.62
▸ SMN1; SMN2 Q16637 2/20 0.59
▸ ALDH1A1 P00352 1/20 0.59
▸ LMNA P02545 1/20 0.59
▸ MAPT P10636 1/20 0.58
▸ DEGS1 O15121 1/20 0.58
▸ KCNK3 O14649 1/20 0.57
▸ KCNK9 Q9NPC2 1/20 0.57
▸ CASP3 P42574 1/20 0.56
▸ SENP7 Q9BQF6 1/20 0.56
▸ SENP6 Q9GZR1 1/20 0.56
▸ HDAC8 Q9BY41 1/20 0.56

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
SCHEMBL13451640 0.88 MEN1 (0.73) KMT2AMEN1NPC1RAB9APOLB
SCHEMBL14413344 0.80 MEN1 (0.72) KMT2AMEN1NPC1RAB9APOLB
SCHEMBL8133663 0.79 RAB9A (1.00) KMT2AMEN1NPC1RAB9APOLB
SCHEMBL3949532 0.79 KMT2A (0.78) KMT2AMEN1NPC1RAB9APOLB
SCHEMBL10960859 0.77 KMT2A (1.00) KMT2AMEN1NPC1RAB9APOLB
SCHEMBL11805645 0.77 POLB (0.59) KMT2AMEN1NPC1RAB9APOLB
SCHEMBL6836463 0.76 KMT2A (0.56) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL12247950 0.76 NPC1 (0.69) KMT2AMEN1NPC1RAB9ASMN1; SMN2
SCHEMBL4548097 0.76 ABCG2 (0.65) KMT2AMEN1NPC1RAB9APOLB
SCHEMBL26889396 0.75 DEGS1 (0.79) KMT2AMEN1NPC1RAB9APOLB

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-1073081-C Naphthol derivatives and process for producing the same UENO SEIYAKU OYO KENKYUJO KK (JP) 2001-10-17 — — CN disclosed
CN-1155882-A Naphthol derivatives and process for producing the same UENO SEIYAKU OYO KENKYUJO KK (JP) 1997-07-30 — — CN disclosed
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