SCHEMBL7501630

SCHEMBL7501630

Cn1cc(C(=O)C(=O)Cl)c2c(Br)cccc21

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 2/20 0.40
MITF O75030 1/20 0.40
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CNR2 P34972 3/20 0.38
NR4A2 P43354 1/20 0.38
POLB P06746 1/20 0.38
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CNR1 P21554 1/20 0.36
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
MAOB P27338 1/20 0.34

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
SCHEMBL3580870 0.83 POLB (0.44) KMT2AALDH1A1LMNAMITFMAPT
SCHEMBL7498303 0.82 POLB (0.41) KMT2AALDH1A1LMNAMITFMAPT
SCHEMBL7386420 0.79 ABCG2 (0.47) KMT2AALDH1A1LMNAMITFMAPT
SCHEMBL20604979 0.79 NR4A2 (0.59) KMT2AALDH1A1MAPTNR4A2MEN1
SCHEMBL28045859 0.79 POLB (0.41) KMT2AALDH1A1LMNAMITFMAPT
SCHEMBL461911 0.74 ALDH1A1 (0.64) KMT2AALDH1A1LMNAMITFMAPT
SCHEMBL1925007 0.72 CNR2 (0.47) KMT2ALMNAMAPTNPSR1CNR2
SCHEMBL20604857 0.71 NR4A2 (0.56) KMT2AALDH1A1LMNAMAPTNR4A2
SCHEMBL7504662 0.70 KMT2A (0.40) KMT2AALDH1A1LMNAMITFMAPT
SCHEMBL7385651 0.70 KMT2A (0.41) KMT2AALDH1A1LMNAMITFMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0915870-B1 SUBSTITUTED BISINDOLYLMALEIMIDES FOR THE INHIBITION OF CELL PROLIFERATION HOFFMANN LA ROCHE (CH) 2002-09-25 EP disclosed
US-6228877-B1 ANTICARCINOGENIC, ANTITUMOR AND ANTIPROLIFERATIVE AGENTS HOFFMANN-LA ROCHE INC. 2001-05-08 US disclosed
EP-0915870-A1 SUBSTITUTED BISINDOLYLMALEIMIDES FOR THE INHIBITION OF CELL PROLIFERATION F. HOFFMANN-LA ROCHE AG (CH) 1999-05-19 EP disclosed
WO-1998004551-A1 SUBSTITUTED BISINDOLYLMALEIMIDES FOR THE INHIBITION OF CELL PROLIFERATION F. HOFFMANN-LA ROCHE AG (CH) 1998-02-05 WO disclosed