SCHEMBL3051684

SCHEMBL3051684

COc1ccc(NC(=O)c2cc3cccc(OC)c3cc2O)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 11/20 0.74
MEN1 O00255 10/20 0.74
NPC1 O15118 7/20 0.74
RAB9A P51151 6/20 0.74
CASP3 P42574 1/20 0.74
SENP7 Q9BQF6 1/20 0.74
SENP6 Q9GZR1 1/20 0.74
MAPT P10636 2/20 0.61
KDM4E B2RXH2 1/20 0.61
CACNA1B Q00975 1/20 0.61
APBA1 Q02410 1/20 0.61
POLB P06746 6/20 0.60
MAPK1 P28482 1/20 0.56
APOBEC3A P31941 1/20 0.56
APOBEC3G Q9HC16 1/20 0.56
AHR P35869 2/20 0.55
PNLIP P16233 1/20 0.53
MAOB P27338 1/20 0.53
PLG P00747 1/20 0.52
KLK1 P06870 1/20 0.52

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
SCHEMBL12521444 0.90 KMT2A (0.62) KMT2AMEN1NPC1RAB9ACASP3
SCHEMBL2743112 0.88 MEN1 (0.74) KMT2AMEN1NPC1RAB9ACASP3
SCHEMBL13479691 0.87 MEN1 (0.73) KMT2AMEN1NPC1RAB9ACASP3
SCHEMBL29644384 0.86 NPC1 (1.00) KMT2AMEN1NPC1RAB9ACASP3
SCHEMBL2048865 0.86 NPC1 (1.00) KMT2AMEN1NPC1RAB9ACASP3
SCHEMBL10815220 0.82 MAPT (0.65) KMT2AMEN1NPC1RAB9ACASP3
SCHEMBL12952660 0.81 POLB (0.65) KMT2AMEN1NPC1RAB9ACASP3
SCHEMBL2743111 0.79 MEN1 (0.82) KMT2AMEN1NPC1RAB9ACASP3
SCHEMBL5344077 0.79 KDM4E (0.61) KMT2AMEN1MAPTKDM4EPOLB
SCHEMBL3045065 0.78 POLB (0.76) KMT2AMEN1NPC1RAB9ACASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8202327-B2 Pigment composition, inkjet recording ink, coloring composition for color filter, and color filter FUJIFILM CORPORATION (JP) 2012-06-19 US disclosed
US-20120001133-A1 PIGMENT COMPOSITION, INKJET RECORDING INK, COLORING COMPOSITION FOR COLOR FILTER, AND COLOR FILTER FUJIFILM CORPORATION (JP) 2012-01-05 US disclosed
EP-2402404-A1 Pigment composition, inkjet recording ink, coloring composition for color filter, and color filter FUJIFILM Corporation (JP) 2012-01-04 EP disclosed