SCHEMBL8555030

SCHEMBL8555030

O=C1c2ccc(Br)cc2CC1Br

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 2/20 0.54
PARP10 Q53GL7 2/20 0.43
TDP2 O95551 1/20 0.43
PARP11 Q9NR21 1/20 0.43
S100A4 P26447 1/20 0.42
SRD5A1 P18405 2/20 0.39
SRD5A2 P31213 1/20 0.39
HSP90AA1 P07900 1/20 0.38
TLR9 Q9NR96 1/20 0.38
PTPRC P08575 1/20 0.37
PBRM1 Q86U86 1/20 0.37
BCL2 P10415 1/20 0.36
MCL1 Q07820 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL17675410 0.85 METAP1 (0.44) METAP1PARP10TDP2S100A4HSP90AA1
SCHEMBL8749446 0.81 PARP10 (0.49) METAP1PARP10TDP2PARP11S100A4
SCHEMBL206438 0.81 PARP10 (0.49) METAP1PARP10TDP2PARP11S100A4
SCHEMBL1238953 0.79 ACHE (0.46) METAP1SRD5A1
SCHEMBL22012874 0.79 METAP1 (0.56) METAP1PARP10TDP2PARP11S100A4
SCHEMBL1500072 0.79 METAP1 (0.56) METAP1PARP10TDP2PARP11S100A4
SCHEMBL6972986 0.79 METAP1 (0.54) METAP1PARP10PARP11SRD5A1
SCHEMBL20951374 0.79 METAP1 (0.53) METAP1PARP10TDP2PARP11S100A4
SCHEMBL2370122 0.79 METAP1 (0.53) METAP1S100A4SRD5A1SRD5A2CES1
SCHEMBL2065931 0.79 PARP10 (0.46) METAP1PARP10TDP2PARP11S100A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014089324-A1 SUBSTITUTED CYCLIC COMPOUNDS AND METHODS OF USE CALITOR SCIENCES, LLC (US) 2014-06-12 WO disclosed
EP-0662971-B1 5H,10H-IMIDAZO[1,2-a]INDENO[1,2-e]PYRAZINE-4-ONE DERIVATIVES, PREPARATION THEREOF AND MEDICAMENTS CONTAINING THEM RHONE POULENC RORER SA (FR) 1998-05-13 EP disclosed
US-5677306-A ANTAGONIZING ALPHA-AMINO-3-HYDROXY-5-METHYL-4-ISOXAZOLEPROPIONIC ACID RECEPTOR, USEFUL FOR TREATING ALL ISCHEMIAS RHONE-POULENC RORER S.A. (FR) 1997-10-14 US disclosed
EP-0346107-B1 Arylfluoroalkenamides and their use as pesticides ROUSSEL UCLAF (FR) 1995-09-13 EP disclosed
EP-0662971-A1 DERIVATIVES OF 5H,10H-IMIDAZO 1,2-a]INDENO 1,2-e]PYRAZINE-4-ONE, PREPARATION THEREOF AND MEDICAMENTS CONTAINING THEM Aventis Pharma S.A. (FR) 1995-07-19 EP disclosed
WO-1994007893-A1 DERIVATIVES OF 5H,10H-IMIDAZO[1,2-a]INDENO[1,2-e]PYRAZINE-4-ONE, PREPARATION THEREOF AND MEDICAMENTS CONTAINING THEM RHONE-POULENC RORER S.A. (FR) 1994-04-14 WO disclosed
US-5180737-A Insecticides, nematocides or anthelmintics ROUSSEL UCLAF (FR) 1993-01-19 US disclosed
EP-0346107-A2 Arylfluoroalkenamides and their use as pesticides ROUSSEL UCLAF (FR) 1989-12-13 EP disclosed