SCHEMBL11041703

SCHEMBL11041703

CCCNC(=O)Nc1ccc(NNC(=O)I)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.57
MEN1 O00255 2/20 0.57
MAPT P10636 4/20 0.50
EPHX1 P07099 4/20 0.48
ALDH1A1 P00352 1/20 0.48
HTT P42858 1/20 0.48
LMNA P02545 1/20 0.46
CNR1 P21554 1/20 0.45
NAMPT P43490 1/20 0.45
HDAC1 Q13547 2/20 0.45
HDAC2 Q92769 2/20 0.45
RAB9A P51151 3/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C19 P33261 1/20 0.44
NPC1 O15118 2/20 0.44
MITF O75030 1/20 0.44
S1PR1 P21453 1/20 0.44
GHSR Q92847 1/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL11045580 0.90 EPHX1 (0.62) KMT2AMAPTEPHX1ALDH1A1HTT
SCHEMBL11044296 0.88 EPHX1 (0.65) KMT2AMAPTEPHX1ALDH1A1HTT
SCHEMBL10356039 0.86 MAPT (0.59) KMT2AMEN1MAPTEPHX1ALDH1A1
SCHEMBL8803832 0.82 KMT2A (0.66) KMT2AMEN1MAPTEPHX1ALDH1A1
SCHEMBL23456385 0.80 KMT2A (0.64) KMT2AMEN1MAPTEPHX1ALDH1A1
SCHEMBL10192175 0.78 MEN1 (0.66) KMT2AMEN1MAPTEPHX1ALDH1A1
SCHEMBL14423986 0.78 MAPT (0.76) KMT2AMEN1MAPTEPHX1ALDH1A1
SCHEMBL11047135 0.78 ALDH1A1 (0.56) KMT2AMEN1MAPTEPHX1ALDH1A1
SCHEMBL14423994 0.78 KMT2A (0.66) KMT2AMEN1MAPTEPHX1ALDH1A1
SCHEMBL11055784 0.78 KMT2A (0.57) KMT2AMEN1MAPTEPHX1ALDH1A1

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
US-4481285-A IMPROVED SHAPPNESS AND EDGE EFFECTS FUJI PHOTO FILM CO., LTD. (JP) 1984-11-06 US disclosed