SCHEMBL7560962

SCHEMBL7560962

CCCCCC(=O)c1oc2ccccc2c1N

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.65
AHR P35869 2/20 0.58
MAPT P10636 8/20 0.52
NPC1 O15118 8/20 0.52
KMT2A Q03164 3/20 0.52
SMN1; SMN2 Q16637 7/20 0.51
RAB9A P51151 6/20 0.51
HTT P42858 2/20 0.51
LMNA P02545 1/20 0.51
ALDH1A1 P00352 4/20 0.48
HPGD P15428 4/20 0.48
TDP1 Q9NUW8 2/20 0.48
MEN1 O00255 2/20 0.48
POLB P06746 1/20 0.48
HSD17B10 Q99714 3/20 0.45
HCRTR1 O43613 1/20 0.45
TSHR P16473 1/20 0.45
CASP1 P29466 1/20 0.45
USP2 O75604 1/20 0.45
NFKB1 P19838 1/20 0.45

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
SCHEMBL13664957 0.83 KDM4E (0.66) KDM4EAHRMAPTNPC1KMT2A
SCHEMBL19877326 0.83 LMNA (0.51) KDM4ENPC1SMN1; SMN2RAB9AHTT
SCHEMBL19890164 0.81 LMNA (0.49) KDM4ENPC1SMN1; SMN2RAB9AHTT
SCHEMBL6857835 0.75 KDM4E (0.68) KDM4EAHRMAPTNPC1KMT2A
SCHEMBL30168106 0.75 KDM4E (0.68) KDM4EAHRMAPTNPC1KMT2A
SCHEMBL13744783 0.75 MAPT (0.60) KDM4EAHRMAPTNPC1KMT2A
SCHEMBL10105364 0.74 OXER1 (0.52) HTTLMNA
SCHEMBL585270 0.74 KDM4E (1.00) KDM4EAHRMAPTNPC1KMT2A
SCHEMBL29502916 0.74 KDM4E (1.00) KDM4EAHRMAPTNPC1KMT2A
SCHEMBL1006030 0.73 MAPT (0.67) KDM4EAHRMAPTNPC1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0873331-B1 BENZOFURAN CARBOXAMIDES AND SULPHONAMIDES DARWIN DISCOVERY LTD (GB) 2002-04-03 EP disclosed