SCHEMBL3674235

SCHEMBL3674235

[O-][n+]1ccccc1C(I)I

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 1/20 0.32
RAB9A P51151 2/20 0.31
HDAC8 Q9BY41 2/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
SLC2A1 P11166 1/20 0.30

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
SCHEMBL3626864 0.76 LMNA (0.43) LMNAHTTKMT2AL3MBTL1KDM4E
SCHEMBL996540 0.76 KMT2A (0.44) LMNAHTTKMT2AL3MBTL1KDM4E
SCHEMBL11767521 0.73 L3MBTL1 (0.42) LMNAHTTKMT2AL3MBTL1KDM4E
SCHEMBL31119425 0.73 L3MBTL1 (0.42) LMNAHTTKMT2AL3MBTL1KDM4E
SCHEMBL11256258 0.73 KMT2A (0.42) LMNAHTTKMT2AL3MBTL1KDM4E
SCHEMBL31119438 0.70 KMT2A (0.40) LMNAHTTKMT2AL3MBTL1KDM4E
SCHEMBL10116257 0.70 KMT2A (0.40) LMNAHTTKMT2AL3MBTL1KDM4E
SCHEMBL7412921 0.70 KMT2A (0.40) LMNAHTTKMT2AL3MBTL1KDM4E
SCHEMBL4959692 0.69 LMNA (0.36) LMNAHTTKMT2AL3MBTL1KDM4E
SCHEMBL29457422 0.69 LMNA (0.36) LMNAHTTKMT2AL3MBTL1KDM4E

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
US-8287631-B2 Compounds for preventing ghost odour THOR GMBH (DE) 2012-10-16 US disclosed
US-20100186631-A1 Compounds for preventing ghost odour THOR GMBH (DE) 2010-07-29 US disclosed