SCHEMBL7771196

SCHEMBL7771196

C=CCN(N)c1ccc(N(N)CC=C)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.40
ADORA2A P29274 3/20 0.40
CSNK1A1 P48729 2/20 0.40
CSNK1D P48730 2/20 0.40
CSNK1G1 Q9HCP0 2/20 0.40
FGR P09769 1/20 0.40
PIM1 P11309 1/20 0.40
DYRK1A Q13627 1/20 0.40
HIPK2 Q9H2X6 1/20 0.40
CASP3 P42574 2/20 0.39
POLB P06746 4/20 0.38
L3MBTL1 Q9Y468 5/20 0.38
MAPT P10636 5/20 0.38
ALDH1A1 P00352 4/20 0.38
LMNA P02545 3/20 0.38
MAPK1 P28482 3/20 0.38
TDP1 Q9NUW8 3/20 0.38
NSD2 O96028 2/20 0.38
EGFR P00533 1/20 0.38
PKM P14618 1/20 0.37

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
SCHEMBL7129845 0.89 L3MBTL1 (0.53) MAOAADORA2ACSNK1A1CSNK1DCSNK1G1
SCHEMBL728510 0.72 MEN1 (0.60) MAOAADORA2ACASP3POLBL3MBTL1
SCHEMBL10813403 0.72 TOP2B (0.45) MAOACASP3POLBL3MBTL1MAPT
SCHEMBL7302336 0.72 C5AR1 (0.35) ALDH1A1LMNAHTTC5AR1ESR1
SCHEMBL10891900 0.71 POLB (0.35) MAOACASP3POLBL3MBTL1MAPT
SCHEMBL7122665 0.70 MEN1 (0.54) MAOAADORA2APOLBL3MBTL1MAPT
SCHEMBL7208666 0.69 NPC1 (0.39) CASP3POLBL3MBTL1MAPTALDH1A1
SCHEMBL5490438 0.69 KMT2A (0.41) POLBALDH1A1LMNATDP1KMT2A
Anthraquinone SCHEMBL8517968 0.68 KMT2A (0.57) MAOAADORA2ACSNK1A1CSNK1DCSNK1G1
SCHEMBL1468909 0.67 GABRA1 (0.39) ALDH1A1LMNAHTTC5AR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0752857-B1 AN IMPROVED METHOD OF SYNTHESIS FOR 6,9-BIS (2-AMINOETHYL)AMINO]BENZO g]ISOQUINOLINE-5,10-DIONE AND ITS DIMALEATE SALT NOVUSPHARMA SPA (IT) 2001-07-25 EP disclosed
US-5616709-A Method of synthesis for 6,9-bis[(2-aminoethyl)amino]benzo[g]isoquinoline-5,10-dione and its dimaleate salt BOEHRINGER MANNHEIM GMBH (IT) 1997-04-01 US disclosed
EP-0752857-A1 AN IMPROVED METHOD OF SYNTHESIS FOR 6,9-BIS (2-AMINOETHYL)AMINO]BENZO g]ISOQUINOLINE-5,10-DIONE AND ITS DIMALEATE SALT BOEHRINGER MANNHEIM ITALIA S.p.A. (IT) 1997-01-15 EP disclosed
US-5587382-A ANTITUMOR AGENTS BOEHRINGER MANNHEIM ITALIA, SPA (IT) 1996-12-24 US disclosed
US-5506232-A 6,9-bis[(2-aminoethyl)amino]benzo[g]isoquinoline-5,10-dione and its dimaleate salt BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1996-04-09 US disclosed
WO-1995026189-A1 AN IMPROVED METHOD OF SYNTHESIS FOR 6,9-BIS[(2-AMINOETHYL)AMINO]BENZO[g]ISOQUINOLINE-5,10-DIONE AND ITS DIMALEATE SALT BOEHRINGER MANNHEIM ITALIA, S.P.A. (US) 1995-10-05 WO disclosed
US-4894451-A Unsymmetrical 1,4-bis(aminoalkylamino)-anthracene-9, 10-diones and derivatives THE UNIVERSITY OF VERMONT (US) 1990-01-16 US disclosed