SCHEMBL7683405

SCHEMBL7683405

CCOC(=O)C1(C2c3[nH]c4ccc(Br)cc4c3CCN2C(=O)c2ccno2)CCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.38
LMNA P02545 4/20 0.35
MAPT P10636 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 3/20 0.35
NPSR1 Q6W5P4 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
POLB P06746 1/20 0.35
GAA P10253 2/20 0.35
HTT P42858 1/20 0.35
NPC1 O15118 1/20 0.34
MITF O75030 1/20 0.34
TNF P01375 1/20 0.34
RAB9A P51151 1/20 0.34
NOD2 Q9HC29 1/20 0.34
NOD1 Q9Y239 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL7683829 0.91 LMNA (0.46) KIF11LMNAMAPTMEN1KMT2A
SCHEMBL7844124 0.88 KIF11 (0.40) KIF11MAPTALDH1A1NPSR1KDM4E
SCHEMBL7676645 0.84 KIF11 (0.38) KIF11LMNAMAPTMEN1KMT2A
SCHEMBL7855705 0.79 SIRT1 (0.45) KIF11LMNAMAPTALDH1A1MAPKAPK2
SCHEMBL7680170 0.78 LMNA (0.52) KIF11LMNAMAPTMEN1KMT2A
SCHEMBL7681633 0.78 MEN1 (0.48) KIF11LMNAMAPTMEN1KMT2A
SCHEMBL7693228 0.78 MEN1 (0.48) KIF11LMNAMAPTMEN1KMT2A
SCHEMBL7680650 0.77 MAPT (0.46) KIF11MAPTKMT2AALDH1A1TDP1
SCHEMBL7680379 0.77 MAPT (0.51) KIF11LMNAMAPTMEN1KMT2A
SCHEMBL7683286 0.76 DHODH (0.49) KIF11LMNAMAPTMEN1KMT2A

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-6350757-B1 Beta-carboline compounds LES LABORATOIRES SERVIER (FR) 2002-02-26 US disclosed