SCHEMBL27364081

SCHEMBL27364081

COc1cc(NC(=O)c2cccc3ccccc23)c(OC)cc1NC(=O)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.65
MEN1 O00255 4/20 0.65
SMN1; SMN2 Q16637 3/20 0.61
MAPK1 P28482 3/20 0.61
MAPT P10636 2/20 0.61
AHR P35869 1/20 0.61
ALDH1A1 P00352 2/20 0.60
KDM4E B2RXH2 2/20 0.59
HSD17B10 Q99714 1/20 0.59
KCNK3 O14649 1/20 0.57
KCNK9 Q9NPC2 1/20 0.57
NPC1 O15118 3/20 0.57
RAB9A P51151 2/20 0.57
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
LMNA P02545 1/20 0.56
NOD2 Q9HC29 1/20 0.55

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
SCHEMBL92220 0.82 RAB9A (0.59) KMT2AMEN1SMN1; SMN2MAPTALDH1A1
SCHEMBL92267 0.81 KMT2A (0.55) KMT2AMEN1SMN1; SMN2MAPK1MAPT
SCHEMBL29886104 0.80 GRM5 (0.65) KMT2AMEN1SMN1; SMN2MAPTALDH1A1
SCHEMBL28577355 0.80 GRM5 (0.65) KMT2AMEN1SMN1; SMN2MAPTALDH1A1
SCHEMBL13788777 0.79 MEN1 (0.78) KMT2AMEN1SMN1; SMN2MAPK1MAPT
SCHEMBL825844 0.78 MEN1 (0.76) KMT2AMEN1SMN1; SMN2MAPK1MAPT
SCHEMBL11692633 0.77 MEN1 (0.50) KMT2AMEN1SMN1; SMN2MAPK1MAPT
SCHEMBL29405219 0.77 MEN1 (0.74) KMT2AMEN1SMN1; SMN2MAPK1MAPT
SCHEMBL592866 0.77 MEN1 (0.74) KMT2AMEN1SMN1; SMN2MAPK1MAPT
SCHEMBL16231124 0.76 MEN1 (0.73) KMT2AMEN1SMN1; SMN2MAPK1MAPT

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